Chemical Properties of Propane, 1-nitro- (CAS 108-03-2)

InChI

InChI=1S/C3H7NO2/c1-2-3-4(5)6/h2-3H2,1H3

InChI Key

JSZOAYXJRCEYSX-UHFFFAOYSA-N

Formula

C3H7NO2

SMILES

CCC[N+](=O)[O-]

Molecular Weight¹

89.09

CAS

108-03-2

Other Names

• 1-NP
• 1-Nitropan
• 1-nitropropane
• N-Nitropropane
• NiPar S-10
• n-C3H7NO2

• ω : Acentric Factor.
• α_p : Isobaric thermal expansion coefficient (1/K).
• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,liquid : Liquid phase heat capacity (J/mol×K).
• μ : Dipole Moment (debye).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• NFPA Fire : NFPA Fire Rating.
• NFPA Health : NFPA Health Rating.
• NFPA Safety : NFPA Safety Rating.
• P_c : Critical Pressure (kPa).
• P_triple : Triple Point Pressure (kPa).
• P_vap : Vapor pressure (kPa).
• ρ_l : Liquid Density (kg/m³).
• I_np : Non-polar retention indices.
• I_p : Polar retention indices.
• γ : Surface Tension (N/m).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• λ_gas : Gas thermal conductivity (W/m×K).
• λ_liquid : Liquid thermal conductivity (W/m×K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• U_Qi : UNIQUAC Qi Parameter.
• U_Ri : UNIQUAC Ri Parameter.
• V_c : Critical Volume (m³/kmol).
• Z_c : Critical Compressibility.
• Z_ra : Rackett Parameter.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	[0.3533; 0.4128]
ω	0.3533		PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value
ω	0.4128		ChemSep v8.3 pure component data Compiled value
ω	0.3760		KDB
ΔcH°liquid	[-2014.00; -2000.00]	kJ/mol
ΔcH°liquid	-2014.00 ± 0.40	kJ/mol	NIST
ΔcH°liquid	-2012.10 ± 1.20	kJ/mol	NIST
ΔcH°liquid	-2013.40 ± 2.60	kJ/mol	NIST
ΔcH°liquid	-2000.00	kJ/mol	NIST
μ	3.66	debye	ChemSep v8.3 pure component data Compiled value
ΔfG°	0.33	kJ/mol	ChemSep v8.3 pure component data Compiled value
ΔfH°gas	-124.00	kJ/mol	ChemSep v8.3 pure component data Compiled value
ΔfH°liquid	[-168.80; -167.00]	kJ/mol
ΔfH°liquid	-167.00 ± 0.40	kJ/mol	NIST
ΔfH°liquid	-168.80 ± 1.30	kJ/mol	NIST
ΔfH°liquid	-167.60 ± 2.60	kJ/mol	NIST
ΔfusH°	14.89	kJ/mol	Joback Calculated Property
ΔvapH°	[43.39; 43.90]	kJ/mol
ΔvapH°	43.90	kJ/mol	NIST
ΔvapH°	43.39 ± 0.42	kJ/mol	NIST
IE	[10.75; 10.95]	eV
IE	10.78 ± 0.03	eV	NIST
IE	10.95	eV	NIST
IE	10.75 ± 0.01	eV	NIST
IE	10.81 ± 0.03	eV	NIST
log10WS	[-0.80; -0.80]
log10WS	-0.80		Aq. Solubility Prediction
log10WS	-0.80		Estimated Solubility
logPoct/wat	0.673		Crippen Calculated Property
McVol	70.550	ml/mol	McGowan Calculated Property
NFPA Fire	2		KDB
NFPA Health	1		KDB
NFPA Safety	3		KDB
Pc	[4000.00; 4350.00]	kPa
Pc	4000.00	kPa	PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value
Pc	4350.00	kPa	ChemSep v8.3 pure component data Compiled value
Pc	4000.00	kPa	KDB
Ptriple	6.89e-07	kPa	ChemSep v8.3 pure component data Compiled value
Inp	[660.50; 725.00]
Inp	708.43		NIST
Inp	709.77		NIST
Inp	711.18		NIST
Inp	702.10		NIST
Inp	702.42		NIST
Inp	702.92		NIST
Inp	703.52		NIST
Inp	704.26		NIST
Inp	705.13		NIST
Inp	706.13		NIST
Inp	707.16		NIST
Inp	Outlier 660.50		NIST
Inp	709.97		NIST
Inp	667.00		NIST
Inp	678.00		NIST
Inp	724.00		NIST
Inp	683.00		NIST
Inp	710.00		NIST
Inp	Outlier 661.90		NIST
Inp	Outlier 665.00		NIST
Inp	724.00		NIST
Inp	Outlier 662.00		NIST
Inp	678.00		NIST
Inp	667.00		NIST
Inp	712.00		NIST
Inp	724.00		NIST
Inp	724.00		NIST
Inp	723.00		NIST
Inp	686.00		NIST
Inp	677.00		NIST
Inp	710.00		NIST
Inp	707.00		NIST
Inp	708.00		NIST
Inp	711.00		NIST
Inp	711.00		NIST
Inp	712.00		NIST
Inp	709.00		NIST
Inp	711.00		NIST
Inp	715.00		NIST
Inp	706.00		NIST
Inp	711.00		NIST
Inp	712.00		NIST
Inp	712.00		NIST
Inp	686.00		NIST
Inp	708.00		NIST
Inp	708.00		NIST
Inp	725.00		NIST
Inp	707.00		NIST
Inp	725.00		NIST
Inp	686.00		NIST
Inp	725.00		NIST
Inp	708.43		NIST
Inp	702.92		NIST
Inp	707.16		NIST
Inp	724.00		NIST
Ip	[1216.40; 1279.00]
Ip	1246.10		NIST
Ip	1248.40		NIST
Ip	1251.60		NIST
Ip	1227.20		NIST
Ip	1230.40		NIST
Ip	1233.80		NIST
Ip	1237.80		NIST
Ip	1241.40		NIST
Ip	1216.40		NIST
Ip	Outlier 1279.00		NIST
Ip	1218.00		NIST
Ip	1251.00		NIST
Ip	1220.00		NIST
Ip	1218.00		NIST
Ip	1220.00		NIST
Tboil	[322.30; 404.80]	K
Tboil	404.33	K	ChemSep v8.3 pure component data Compiled value
Tboil	404.70	K	KDB
Tboil	404.80	K	NIST
Tboil	404.33 ± 0.06	K	NIST
Tboil	404.53 ± 0.07	K	NIST
Tboil	404.80 ± 0.60	K	NIST
Tboil	Outlier 322.30 ± 0.70	K	NIST
Tboil	404.15 ± 1.50	K	NIST
Tc	[605.00; 606.00]	K
Tc	606.00	K	PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value
Tc	605.00	K	ChemSep v8.3 pure component data Compiled value
Tc	606.00	K	KDB
Tfus	[165.00; 169.16]	K
Tfus	165.15	K	Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value
Tfus	169.16	K	ChemSep v8.3 pure component data Compiled value
Tfus	165.00	K	KDB
Tfus	169.16 ± 0.06	K	NIST
Tfus	168.59 ± 0.05	K	NIST
Ttriple	169.16	K	ChemSep v8.3 pure component data Compiled value
UQi	2.95		ChemSep v8.3 pure component data Compiled value
URi	3.36		ChemSep v8.3 pure component data Compiled value
Vc	[0.283; 0.288]	m3/kmol
Vc	0.283	m3/kmol	PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value
Vc	0.288	m3/kmol	ChemSep v8.3 pure component data Compiled value
Zc	0.2490000		ChemSep v8.3 pure component data Compiled value
Zra	0.25		ChemSep v8.3 pure component data Compiled value

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
ΔvapH	[40.60; 42.60]	kJ/mol	[349.00; 367.50]
ΔvapH	42.60	kJ/mol	349.00	NIST
ΔvapH	40.60	kJ/mol	367.50	NIST
ρl	996.10	kg/m3	298.15	Speed of sound as a function of temperature and pressure for propane derivatives

Datasets

Isobaric coefficient of expansion, 1/K

Fixed		Measured
Temperature, K - Liquid	Pressure, kPa - Liquid	Isobaric coefficient of expansion, 1/K - Liquid
278.15	5000.00	0.0010
278.15	10000.00	0.0010
278.15	15000.00	0.0010
278.15	20000.00	0.0010
278.15	25000.00	0.0010
278.15	30000.00	0.0009
278.15	35000.00	0.0009
278.15	40000.00	0.0009
278.15	45000.00	0.0009
278.15	50000.00	0.0009
278.15	55000.00	0.0009
288.15	5000.00	0.0011
288.15	10000.00	0.0010
288.15	15000.00	0.0010
288.15	20000.00	0.0010
288.15	25000.00	0.0010
288.15	30000.00	0.0010
288.15	35000.00	0.0009
288.15	40000.00	0.0009
288.15	45000.00	0.0009
288.15	50000.00	0.0009
288.15	55000.00	0.0009
298.15	5000.00	0.0011
298.15	10000.00	0.0010
298.15	15000.00	0.0010
298.15	20000.00	0.0010
298.15	25000.00	0.0010
298.15	30000.00	0.0010
298.15	35000.00	0.0009
298.15	40000.00	0.0009
298.15	45000.00	0.0009
298.15	50000.00	0.0009
298.15	55000.00	0.0009
308.15	5000.00	0.0011
308.15	10000.00	0.0011
308.15	15000.00	0.0010
308.15	20000.00	0.0010
308.15	25000.00	0.0010
308.15	30000.00	0.0010
308.15	35000.00	0.0009
308.15	40000.00	0.0009
308.15	45000.00	0.0009
308.15	50000.00	0.0009
308.15	55000.00	0.0009
318.15	5000.00	0.0011
318.15	10000.00	0.0011
318.15	15000.00	0.0011
318.15	20000.00	0.0010
318.15	25000.00	0.0010
318.15	30000.00	0.0010
318.15	35000.00	0.0010
318.15	40000.00	0.0009
318.15	45000.00	0.0009
318.15	50000.00	0.0009
318.15	55000.00	0.0009
328.15	5000.00	0.0012
328.15	10000.00	0.0011
328.15	15000.00	0.0011
328.15	20000.00	0.0010
328.15	25000.00	0.0010
328.15	30000.00	0.0010
328.15	35000.00	0.0010
328.15	40000.00	0.0009
328.15	45000.00	0.0009
328.15	50000.00	0.0009
328.15	55000.00	0.0009
338.15	5000.00	0.0012
338.15	10000.00	0.0011
338.15	15000.00	0.0011
338.15	20000.00	0.0011
338.15	25000.00	0.0010
338.15	30000.00	0.0010
338.15	35000.00	0.0010
338.15	40000.00	0.0009
338.15	45000.00	0.0009
338.15	50000.00	0.0009
338.15	55000.00	0.0009
348.15	5000.00	0.0012
348.15	10000.00	0.0012
348.15	15000.00	0.0011
348.15	20000.00	0.0011
348.15	25000.00	0.0010
348.15	30000.00	0.0010
348.15	35000.00	0.0010
348.15	40000.00	0.0009
348.15	45000.00	0.0009
348.15	50000.00	0.0009
348.15	55000.00	0.0009
Reference

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[65.15; 251.87]	J/mol×K	[150.00; 1500.00]	ChemSep v8.3 pure component data Compiled value
Equation			Y = A + exp(B/T + C + D·T + E·T²) Y is Cp,gas in J/mol×K, T in K
Coefficient A			5.77450e+01
Coefficient B			-5.38370e+02
Coefficient C			5.57524e+00
Coefficient D			1.12020e-04
Coefficient E			-5.15020e-08
Temperature range, min.			150.00
Temperature range, max.			1500.00
Cp,gas	65.15	J/mol×K	150.00	Calculated Property
Cp,gas	102.88	J/mol×K	300.00	Calculated Property
Cp,gas	140.75	J/mol×K	450.00	Calculated Property
Cp,gas	170.66	J/mol×K	600.00	Calculated Property
Cp,gas	193.72	J/mol×K	750.00	Calculated Property
Cp,gas	211.62	J/mol×K	900.00	Calculated Property
Cp,gas	225.64	J/mol×K	1050.00	Calculated Property
Cp,gas	236.65	J/mol×K	1200.00	Calculated Property
Cp,gas	245.25	J/mol×K	1350.00	Calculated Property
Cp,gas	251.87	J/mol×K	1500.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Cp,liquid	[140.79; 196.50]	J/mol×K	[169.16; 404.33]	ChemSep v8.3 pure component data Compiled value
Equation			Y = A + exp(B/T + C + D·T + E·T²) Y is Cp,liquid in J/mol×K, T in K
Coefficient A			-8.83560e+00
Coefficient B			1.76430e+02
Coefficient C			2.62224e+00
Coefficient D			9.61760e-03
Coefficient E			-9.92530e-06
Temperature range, min.			169.16
Temperature range, max.			404.33
Cp,liquid	140.79	J/mol×K	169.16	Calculated Property
Cp,liquid	143.39	J/mol×K	195.29	Calculated Property
Cp,liquid	149.07	J/mol×K	221.42	Calculated Property
Cp,liquid	156.43	J/mol×K	247.55	Calculated Property
Cp,liquid	164.57	J/mol×K	273.68	Calculated Property
Cp,liquid	172.80	J/mol×K	299.81	Calculated Property
Cp,liquid	180.57	J/mol×K	325.94	Calculated Property
Cp,liquid	187.37	J/mol×K	352.07	Calculated Property
Cp,liquid	192.80	J/mol×K	378.20	Calculated Property
Cp,liquid	196.50	J/mol×K	404.33	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0022125; 0.0003052]	Pa×s	[240.00; 404.33]	ChemSep v8.3 pure component data Compiled value
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.99970e+01
Coefficient B			1.65300e+03
Coefficient C			1.26050e+00
Coefficient D			1.51940e-06
Coefficient E			2.00000e+00
Temperature range, min.			240.00
Temperature range, max.			404.33
η	0.0022125	Pa×s	240.00	Calculated Property
η	0.0015120	Pa×s	258.26	Calculated Property
η	0.0010961	Pa×s	276.52	Calculated Property
η	0.0008335	Pa×s	294.78	Calculated Property
η	0.0006593	Pa×s	313.04	Calculated Property
η	0.0005389	Pa×s	331.29	Calculated Property
η	0.0004528	Pa×s	349.55	Calculated Property
η	0.0003894	Pa×s	367.81	Calculated Property
η	0.0003418	Pa×s	386.07	Calculated Property
η	0.0003052	Pa×s	404.33	Calculated Property

Property	Value	Unit	Temperature (K)	Source
ΔvapH	[48.90; 0.00]	kJ/mol	[169.16; 605.00]	ChemSep v8.3 pure component data Compiled value
Equation			Y = A·(1 − Tr)^(B + C·Tr + D·Tr² + E·Tr³), Tr = T/Tc Y is ΔvapH in kJ/mol, T in K
Coefficient A			5.63070e+01
Coefficient B			4.77670e-01
Coefficient C			-1.83380e-01
Coefficient D			5.72550e-02
Coefficient E			-2.83110e-02
Critical temperature, Tc (K)			6.05000e+02
Temperature range, min.			169.16
Temperature range, max.			605.00
ΔvapH	48.90	kJ/mol	169.16	Calculated Property
ΔvapH	46.74	kJ/mol	217.59	Calculated Property
ΔvapH	44.51	kJ/mol	266.01	Calculated Property
ΔvapH	42.18	kJ/mol	314.44	Calculated Property
ΔvapH	39.68	kJ/mol	362.87	Calculated Property
ΔvapH	36.92	kJ/mol	411.29	Calculated Property
ΔvapH	33.74	kJ/mol	459.72	Calculated Property
ΔvapH	29.80	kJ/mol	508.15	Calculated Property
ΔvapH	24.14	kJ/mol	556.57	Calculated Property
ΔvapH	0.00	kJ/mol	605.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[297.67; 430.22]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.52908e+01
Coefficient B			-3.95030e+03
Coefficient C			-3.43730e+01
Temperature range, min.			297.67
Temperature range, max.			430.22
Pvap	1.33	kPa	297.67	Calculated Property
Pvap	2.95	kPa	312.40	Calculated Property
Pvap	6.03	kPa	327.13	Calculated Property
Pvap	11.51	kPa	341.85	Calculated Property
Pvap	20.71	kPa	356.58	Calculated Property
Pvap	35.40	kPa	371.31	Calculated Property
Pvap	57.84	kPa	386.04	Calculated Property
Pvap	90.84	kPa	400.76	Calculated Property
Pvap	137.80	kPa	415.49	Calculated Property
Pvap	202.64	kPa	430.22	Calculated Property
Pvap	[1.97e-06; 3809.79]	kPa	[169.16; 605.00]	ChemSep v8.3 pure component data Compiled value
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is Pvap in kPa, T in K
Coefficient A			3.17503e+01
Coefficient B			-5.75064e+03
Coefficient C			-2.11565e+00
Coefficient D			-1.22542e-06
Coefficient E			2.00000e+00
Temperature range, min.			169.16
Temperature range, max.			605.00
Pvap	1.97e-06	kPa	169.16	Calculated Property
Pvap	2.19e-03	kPa	217.59	Calculated Property
Pvap	0.17	kPa	266.01	Calculated Property
Pvap	3.23	kPa	314.44	Calculated Property
Pvap	26.35	kPa	362.87	Calculated Property
Pvap	124.76	kPa	411.29	Calculated Property
Pvap	408.32	kPa	459.72	Calculated Property
Pvap	1027.45	kPa	508.15	Calculated Property
Pvap	2129.70	kPa	556.57	Calculated Property
Pvap	3809.79	kPa	605.00	Calculated Property
Pvap	[7.78e-07; 4121.92]	kPa	[169.16; 605.00]	KDB Vapor Pressure Data
Equation			ln(Y) = A + B/T + C·ln(T) + D·T² + E/T² Y is Pvap in kPa, T in K
Coefficient A			6.95825e+01
Coefficient B			-7.26354e+03
Coefficient C			-7.96077e+00
Coefficient D			4.74813e-06
Coefficient E			0.00000e+00
Temperature range, min.			169.16
Temperature range, max.			605.00
Pvap	7.78e-07	kPa	169.16	Calculated Property
Pvap	1.62e-03	kPa	217.59	Calculated Property
Pvap	0.16	kPa	266.01	Calculated Property
Pvap	3.23	kPa	314.44	Calculated Property
Pvap	26.30	kPa	362.87	Calculated Property
Pvap	122.39	kPa	411.29	Calculated Property
Pvap	396.10	kPa	459.72	Calculated Property
Pvap	1004.92	kPa	508.15	Calculated Property
Pvap	2157.14	kPa	556.57	Calculated Property
Pvap	4121.92	kPa	605.00	Calculated Property
Pvap	[7.61; 101.35]	kPa	[331.80; 404.53]	NIST
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.43629e+01
Coefficient B			-3.37644e+03
Coefficient C			-5.80290e+01
Reference			Dreisbach and Shrader, 1949
Comment			Coefficents calculated by NIST from author's data.
Temperature range, min.			331.80
Temperature range, max.			404.53
Pvap	7.61	kPa	331.80	Calculated Property
Pvap	10.84	kPa	339.88	Calculated Property
Pvap	15.14	kPa	347.96	Calculated Property
Pvap	20.76	kPa	356.04	Calculated Property
Pvap	28.00	kPa	364.12	Calculated Property
Pvap	37.19	kPa	372.21	Calculated Property
Pvap	48.69	kPa	380.29	Calculated Property
Pvap	62.92	kPa	388.37	Calculated Property
Pvap	80.31	kPa	396.45	Calculated Property
Pvap	101.35	kPa	404.53	Calculated Property

Property	Value	Unit	Temperature (K)	Source
ρl	[1120.40; 309.59]	kg/m3	[169.16; 605.00]	ChemSep v8.3 pure component data Compiled value
Equation			Y = A / B^(1 + (1 − T/C)^D) Y is ρl in kg/m3, T in K
Coefficient A			7.57960e+01
Coefficient B			2.44830e-01
Coefficient C			6.05000e+02
Coefficient D			2.74130e-01
Temperature range, min.			169.16
Temperature range, max.			605.00
ρl	1120.40	kg/m3	169.16	Calculated Property
ρl	1075.54	kg/m3	217.59	Calculated Property
ρl	1028.45	kg/m3	266.01	Calculated Property
ρl	978.61	kg/m3	314.44	Calculated Property
ρl	925.22	kg/m3	362.87	Calculated Property
ρl	867.02	kg/m3	411.29	Calculated Property
ρl	801.89	kg/m3	459.72	Calculated Property
ρl	725.49	kg/m3	508.15	Calculated Property
ρl	626.08	kg/m3	556.57	Calculated Property
ρl	309.59	kg/m3	605.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
γ	[0.04; 0.02]	N/m	[165.15; 404.25]	Jasper (1972), surface tension of pure liquid compounds Compiled value
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is γ in N/m, T in K
Coefficient A			6.01808e-02
Coefficient B			-1.00900e-04
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			165.15
Temperature range, max.			404.25
γ	0.04	N/m	165.15	Calculated Property
γ	0.04	N/m	191.72	Calculated Property
γ	0.04	N/m	218.28	Calculated Property
γ	0.04	N/m	244.85	Calculated Property
γ	0.03	N/m	271.42	Calculated Property
γ	0.03	N/m	297.98	Calculated Property
γ	0.03	N/m	324.55	Calculated Property
γ	0.02	N/m	351.12	Calculated Property
γ	0.02	N/m	377.68	Calculated Property
γ	0.02	N/m	404.25	Calculated Property
γ	[0.04; 2.66e-05]	N/m	[169.16; 602.38]	ChemSep v8.3 pure component data Compiled value
Equation			Y = A + exp(B/T + C + D·T + E·T²) Y is γ in N/m, T in K
Coefficient A			-3.55290e-02
Coefficient B			5.85170e-01
Coefficient C			-2.33140e+00
Coefficient D			-9.99470e-04
Coefficient E			-1.11380e-06
Comment			Range stopped where the equation turns negative; ChemSep gives it to 605 K.
Temperature range, min.			169.16
Temperature range, max.			602.38
γ	0.04	N/m	169.16	Calculated Property
γ	0.04	N/m	217.30	Calculated Property
γ	0.03	N/m	265.43	Calculated Property
γ	0.03	N/m	313.57	Calculated Property
γ	0.02	N/m	361.70	Calculated Property
γ	0.02	N/m	409.84	Calculated Property
γ	0.01	N/m	457.98	Calculated Property
γ	0.01	N/m	506.11	Calculated Property
γ	0.00	N/m	554.25	Calculated Property
γ	2.66e-05	N/m	602.38	Calculated Property

Property	Value	Unit	Temperature (K)	Source
λgas	[0.00; 0.07]	W/m×K	[169.16; 1000.00]	ChemSep v8.3 pure component data Compiled value
Equation			Y = A·T^B / (1 + C/T + D/T²) Y is λgas in W/m×K, T in K
Coefficient A			2.21170e-03
Coefficient B			6.15380e-01
Coefficient C			8.75340e+02
Coefficient D			3.12410e+05
Temperature range, min.			169.16
Temperature range, max.			1000.00
λgas	0.00	W/m×K	169.16	Calculated Property
λgas	0.01	W/m×K	261.48	Calculated Property
λgas	0.01	W/m×K	353.79	Calculated Property
λgas	0.02	W/m×K	446.11	Calculated Property
λgas	0.03	W/m×K	538.42	Calculated Property
λgas	0.04	W/m×K	630.74	Calculated Property
λgas	0.05	W/m×K	723.05	Calculated Property
λgas	0.05	W/m×K	815.37	Calculated Property
λgas	0.06	W/m×K	907.68	Calculated Property
λgas	0.07	W/m×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
λliquid	[0.19; 0.13]	W/m×K	[169.16; 404.33]	ChemSep v8.3 pure component data Compiled value
Equation			Y = A + exp(B/T + C + D·T + E·T²) Y is λliquid in W/m×K, T in K
Coefficient A			-6.83810e-02
Coefficient B			1.32210e+01
Coefficient C			-1.36280e+00
Coefficient D			-2.43570e-04
Coefficient E			-1.25350e-06
Temperature range, min.			169.16
Temperature range, max.			404.33
λliquid	0.19	W/m×K	169.16	Calculated Property
λliquid	0.18	W/m×K	195.29	Calculated Property
λliquid	0.17	W/m×K	221.42	Calculated Property
λliquid	0.17	W/m×K	247.55	Calculated Property
λliquid	0.16	W/m×K	273.68	Calculated Property
λliquid	0.15	W/m×K	299.81	Calculated Property
λliquid	0.15	W/m×K	325.94	Calculated Property
λliquid	0.14	W/m×K	352.07	Calculated Property
λliquid	0.13	W/m×K	378.20	Calculated Property
λliquid	0.13	W/m×K	404.33	Calculated Property

Similar Compounds

Find more compounds similar to Propane, 1-nitro-.

Mixtures

• Propane, 1-nitro- + Decane
• Propane, 1-nitro- + Dodecane
• Propane, 1-nitro- + Tridecane
• Propane, 1-nitro- + Tetradecane
• Propane, 1-nitro- + Carbon dioxide
• Propane, 1-nitro- + Cyclohexane
• Propane, 1-nitro- + Carbon Tetrachloride
• Propane, 1-nitro- + p-Xylene

Sources

• KDB Vapor Pressure Data
• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• Jasper (1972), surface tension of pure liquid compounds ChEDL chemicals 1.5.2, from Jasper, J. J. The Surface Tension of Pure Liquid Compounds. J. Phys. Chem. Ref. Data 1972, 1, 841-1010 (as transcribed in Lange's Handbook).
• PSRK revision IV (2005), critical constants and acentric factors of 1000 components ChEDL chemicals 1.5.2, from Horstmann, S.; Jabłoniec, A.; Krafczyk, J.; Fischer, K.; Gmehling, J. PSRK Group Contribution Equation of State: Comprehensive Revision and Extension IV, Including Critical Constants and α-Function Parameters for 1000 Components. Fluid Phase Equilib. 2005, 227, 157-164.
• ChemSep v8.3 pure component data Converted from ChemSep v8.3 pure component data, H. Kooijman and R. Taylor (2021, 2022), Artistic License 2.0; see how the values differ.
• Crippen Method
• Solution thermodynamics near the liquid liquid critical point I. First-order excess derivatives
• Experimental and theoretical study of interaction between organic compounds and 1- (4-sulfobutyl)-3-methylimidazolium based ionic liquids
• Study of interaction between organic compounds and mono or dicationic oxygenated ionic liquids using gas chromatography
• Activity coefficients at infinite dilution of organic solvents and water in 1-butyl-3-methylimidazolium dicyanamide. A literature review of hexane/hex-1-ene separation
• High selective water/butan-1-ol separation on investigation of limiting activity coefficients with [P8,8,8,8][[NTf2] ionic liquid
• Separation of binary mixtures based on limiting activity coefficients data using specific ammonium-based ionic liquid and modelling of thermodynamic functions
• Thermodynamics and activity coefficients at infinite dilution for organic solutes in the ionic liquid 1-butyl-1-methylpyrrolidinium dicyanamide
• New ionic liquid [P4,4,4,4][NTf2] in bio-butanol extraction on investigation of limiting activity coefficients
• Ammonium ionic liquids in extraction of bio-butan-1-ol from water phase using activity coefficients at infinite dilution
• Measurement of activity coefficients at infinite dilution in 1-hexadecyl-3-methylimidazolium tetrafluoroborate ionic liquid
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 4-(2-methoxyethyl)-4-methylmorpholinium bis(trifluoromethylsulfonyl)-amide
• Measurements of activity coefficients at infinite dilution for organic solutes and water in the ionic liquid 1-hexyl-3-methylimidazolium tetracyanoborate
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 1-(2-methoxyethyl)-1-methylpiperidinium bis(trifluoromethylsulfonyl)-amide
• Measurements of activity coefficients at infinite dilution for organic solutes and water in the ionic liquid 1-ethyl-3-methylimidazolium methanesulfonate
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 1-(2-methoxyethyl)-1-methylpyrrolidinium bis(trifluoromethylsulfonyl)-amide
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 4-(2-methoxyethyl)-4-methylmorpholinium trifluorotris(perfluoroethyl)phosphate
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 1-(2-methoxyethyl)- 1-methylpiperidinium trifluorotris(perfluoroethyl)phosphate
• Physicochemical properties and activity coefficients at infinite dilution for organic solutes and water in a novel bicyclic guanidinium superbase-derived protic ionic liquid
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 1-(2-methoxyethyl)- 1-methylpyrrolidinium trifluorotris(perfluoroethyl)phosphate
• Measurements of activity coefficients at infinite dilution for organic solutes and water in N-hexylisoquinolinium thiocyanate, [HiQuin][SCN] using GLC
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 1-(2-hydroxyethyl)- 3-methylimidazolium trifluorotris(perfluoroethyl)phosphate
• Measurements of activity coefficients at infinite dilution for organic solutes and water in the ionic liquid 1-butyl-1-methylpyrrolidinium tricyanomethanide
• Thermodynamics and activity coefficients at infinite dilution for organic solutes and water in the ionic liquid 1-butyl-1-methylmorpholinium tricyanomethanide
• The study of activity coefficients at infinite dilution for organic solutes and water in 1-butyl-4-methylpyridinium dicyanamide, [B4MPy][DCA] using GLC
• Thermodynamics and activity coefficients at infinite dilution for organic solutes, water and diols in the ionic liquid choline bis(trifluoromethylsulfonyl)imide
• Experimental and theoretically study of interaction between organic compounds and tricyanomethanide based ionic liquids
• Activity coefficients at infinite dilution of organic solutes in methylphosphonate based ionic liquids using gas-liquid chromatography
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 4-(3-hydroxypropyl)-4-methylmorpholinium bis(trifluoromethylsulfonyl)-amide
• Activity coefficients at infinite dilution for organic solutes and water in 1-ethyl-1-methylpyrrolidinium lactate
• Activity coefficients at infinite dilution, physicochemical and thermodynamic properties for organic solutes and water in the ionic liquid ethyl-dimethyl-(2-methoxyethyl)ammonium trifluorotris-(perfluoroethyl)phosphate
• A 1-alkylcyanopyridinium-based ionic liquid in the separation processes
• Thermodynamics and selectivity of separation based on activity coefficients at infinite dilution of various solutes in 1-allyl-3-methylimidazolium bis{(trifluoromethyl)sulfonyl}imide ionic liquid
• Separation of aliphatic from aromatic hydrocarbons and sulphur compounds from fuel based on measurements of activity coefficients at infinite dilution for organic solutes and water in the ionic liquid N,N-diethyl-N-methyl-N-(2-methoxy-ethyl)ammonium bis(trifluoromethylsulfonyl)imide
• Thermodynamics and limiting activity coefficients measurements for organic solutes and water in the ionic liquid 1-dodecyl-3-methylimidzolium bis(trifluoromethylsulfonyl) imide
• Speed of sound as a function of temperature and pressure for propane derivatives
• Separation of binary mixtures hexane/hex-1-ene, cyclohexane/cyclohexene and ethylbenzene/styrene based on limiting activity coefficients
• Separation of water/butan-1-ol based on activity coefficients at infinite dilution in 1,3-didecyl-2-methylimidazolium dicyanamide ionic liquid
• Separation of binary mixtures hexane/hex-1-ene, cyclohexane/cyclohexene and ethylbenzene/styrene based on gamma infinity data measurements
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid trihexyl-tetradecyl-phosphonium tricyanomethanide
• Thermodynamic study of molecular interaction-selectivity in separation processes based on limiting activity coefficients
• The use of ionic liquids for separation of binary hydrocarbons mixtures based on gamma infinity data measurements
• Relative Permittivity and Apparent Dipole Moments of Nitromethane, Nitroethane, 1-Nitropropane and 2- Nitropropane in Several Nonpolar Solvents.
• Activity Coefficients at Infinite Dilution of Organic Solutes and Water in Tributylethylphosphonium Diethylphosphate Using Gas Liquid Chromatography: Thermodynamic Properties of Mixtures Containing Ionic Liquids
• Thermodynamic Properties of Mixtures Containing Ionic Liquids: Activity Coefficients at Infinite Dilution of Organic Compounds in 1-Propyl Boronic Acid-3-Alkylimidazolium Bromide and 1-Propenyl-3-alkylimidazolium Bromide Using Inverse Gas Chromatography
• Critical Assessment of CO2 Solubility in Volatile Solvents at 298.15 K
• Activity Coefficients at Infinite Dilution of Organic Compounds in Four New Imidazolium-Based Ionic Liquids
• Partition Coefficients of Organic Compounds in Four New Tetraalkylammonium Bis(trifluoromethylsulfonyl)imide Ionic Liquids Using Inverse Gas Chromatography
• Evaluation of the Performance of Trigeminal Tricationic Ionic Liquids for Separation Problems
• Activity Coefficients at Infinite Dilution for Organic Compounds Dissolved in 1-Alkyl-1-methylpyrrolidinium Bis(trifluoromethylsulfonyl)imide Ionic Liquids Having Six-, Eight-, and Ten-Carbon Alkyl Chains
• Activity Coefficients at Infinite Dilution for Organic Solutes Dissolved in Three 1-Alkyl-1-methylpyrrolidinium Bis(trifluoromethylsulfonyl)imide Ionic Liquids Bearing Short Linear Alkyl Side Chains of Three to Five Carbons
• Infinite Dilution Activity Coefficients of Solutes Dissolved in Two Trihexyl(tetradecyl)phosphonium Ionic Liquids
• Activity Coefficients at Infinite Dilution of Organic Compounds in 1-Butyl-3-methylimidazolium Tetrafluoroborate Using Inverse Gas Chromatography
• Activity Coefficients at Infinite Dilution of Organic Compounds in Trihexyl(tetradecyl)phosphonium Bis(trifluoromethylsulfonyl)imide Using Inverse Gas Chromatography
• Partition Coefficients of Organic Compounds in New Imidazolium and Tetralkylammonium Based Ionic Liquids Using Inverse Gas Chromatography
• Isobaric Thermal Expansivity of Highly Polar Nitrogen Compounds at Temperatures from (278.15 to 348.15) K and at Pressures from (5 to 55) MPa
• Study of Ether-, Alcohol-, or Cyano-Functionalized Ionic Liquids Using Inverse Gas Chromatography
• Joback Method
• KDB
• Aqueous Solubility Prediction Method
• Estimated Solubility Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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