Chemical Properties of 1-Propanamine, N,N-dipropyl- (CAS 102-69-2)

InChI

InChI=1S/C9H21N/c1-4-7-10(8-5-2)9-6-3/h4-9H2,1-3H3

InChI Key

YFTHZRPMJXBUME-UHFFFAOYSA-N

Formula

C9H21N

SMILES

CCCN(CCC)CCC

Molecular Weight¹

143.27

CAS

102-69-2

Other Names

• (n-C3H7)3N
• N,N-DIPROPYL-1-PROPYLAMINE
• N,N-Dipropyl-1-propanamine
• N,N-dipropylpropanamine
• Propyldi-n-propylamine
• TRIPROPYLAMINE
• Tri-n-propylamine
• UN 2260
• propanamine, N,N-dipropyl-

• ω : Acentric Factor.
• PAff : Proton affinity (kJ/mol).
• BasG : Gas basicity (kJ/mol).
• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• P_c : Critical Pressure (kPa).
• P_vap : Vapor pressure (kPa).
• ρ_l : Liquid Density (kg/m³).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.4587		Relay (1.0) Calculated Property
PAff	991.00	kJ/mol	NIST
BasG	960.10	kJ/mol	NIST
ΔcH°liquid	-6335.66 ± 0.79	kJ/mol	NIST
ΔfG°	135.68	kJ/mol	Joback Calculated Property
ΔfH°gas	-160.80 ± 0.80	kJ/mol	NIST
ΔfH°liquid	-206.90 ± 0.79	kJ/mol	NIST
ΔfusH°	22.09	kJ/mol	Joback Calculated Property
ΔvapH°	[46.15; 46.20]	kJ/mol
ΔvapH°	46.17	kJ/mol	NIST
ΔvapH°	46.20 ± 0.10	kJ/mol	NIST
ΔvapH°	46.15 ± 0.07	kJ/mol	NIST
IE	[7.00; 8.00]	eV
IE	7.40	eV	NIST
IE	7.00 ± 0.10	eV	NIST
IE	7.03 ± 0.09	eV	NIST
IE	7.23	eV	NIST
IE	8.00 ± 0.30	eV	NIST
log10WS	-2.28		Aq. Solubility Prediction
logPoct/wat	2.518		Crippen Calculated Property
McVol	147.650	ml/mol	McGowan Calculated Property
Pc	2302.53	kPa	Joback Calculated Property
Inp	[915.00; 964.00]
Inp	918.00		NIST
Inp	917.00		NIST
Inp	915.00		NIST
Inp	915.00		NIST
Inp	964.00		NIST
Inp	964.00		NIST
Inp	962.00		NIST
Inp	917.00		NIST
Inp	917.00		NIST
Inp	937.00		NIST
Inp	937.00		NIST
Inp	927.00		NIST
Inp	927.00		NIST
I	[958.00; 978.00]
I	978.00		NIST
I	970.00		NIST
I	974.00		NIST
I	965.00		NIST
I	968.00		NIST
I	958.00		NIST
Tboil	[427.40; 430.00]	K
Tboil	429.65	K	KDB
Tboil	429.20	K	NIST
Tboil	427.40 ± 0.50	K	NIST
Tboil	429.15 ± 2.00	K	NIST
Tboil	429.15 ± 2.00	K	NIST
Tboil	429.65 ± 1.00	K	NIST
Tboil	429.15 ± 1.50	K	NIST
Tboil	427.65 ± 3.00	K	NIST
Tboil	427.65 ± 3.00	K	NIST
Tboil	429.15 ± 0.50	K	NIST
Tboil	429.15 ± 3.00	K	NIST
Tboil	429.15 ± 2.00	K	NIST
Tboil	430.00 ± 4.00	K	NIST
Tc	580.42	K	Relay (1.0) Calculated Property
Tfus	[172.65; 179.65]	K
Tfus	179.65	K	Aq. Solubility Prediction
Tfus	172.65 ± 0.50	K	NIST
Tfus	179.65 ± 0.50	K	NIST
Vc	0.546	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[303.35; 385.27]	J/mol×K	[417.76; 579.60]
Cp,gas	303.35	J/mol×K	417.76	Joback Calculated Property
Cp,gas	318.41	J/mol×K	444.73	Joback Calculated Property
Cp,gas	332.88	J/mol×K	471.71	Joback Calculated Property
Cp,gas	346.79	J/mol×K	498.68	Joback Calculated Property
Cp,gas	360.15	J/mol×K	525.66	Joback Calculated Property
Cp,gas	372.97	J/mol×K	552.63	Joback Calculated Property
Cp,gas	385.27	J/mol×K	579.60	Joback Calculated Property
η	[0.0005380; 0.0005980]	Pa×s	[303.15; 313.15]
η	0.0005980	Pa×s	303.15	Studies of viscosities of dilute solutions of alkylamine in non-electrolyte solvents. II. Haloalkanes and other polar solvents
η	0.0005380	Pa×s	313.15	Studies of viscosities of dilute solutions of alkylamine in non-electrolyte solvents. II. Haloalkanes and other polar solvents
ΔvapH	45.60	kJ/mol	408.00	NIST
Pvap	[0.20; 1.26]	kPa	[283.15; 313.15]
Pvap	0.20	kPa	283.15	Evaluation of the Vaporization Enthalpies and Liquid Vapor Pressures of (R)-Deprenyl, (S)-Benzphetamine, Alverine, and a Series of Aliphatic Tertiary Amines by Correlation Gas Chromatography at T/K = 298.15
Pvap	0.28	kPa	288.15	Evaluation of the Vaporization Enthalpies and Liquid Vapor Pressures of (R)-Deprenyl, (S)-Benzphetamine, Alverine, and a Series of Aliphatic Tertiary Amines by Correlation Gas Chromatography at T/K = 298.15
Pvap	0.38	kPa	293.15	Evaluation of the Vaporization Enthalpies and Liquid Vapor Pressures of (R)-Deprenyl, (S)-Benzphetamine, Alverine, and a Series of Aliphatic Tertiary Amines by Correlation Gas Chromatography at T/K = 298.15
Pvap	0.52	kPa	298.15	Evaluation of the Vaporization Enthalpies and Liquid Vapor Pressures of (R)-Deprenyl, (S)-Benzphetamine, Alverine, and a Series of Aliphatic Tertiary Amines by Correlation Gas Chromatography at T/K = 298.15
Pvap	0.71	kPa	303.15	Evaluation of the Vaporization Enthalpies and Liquid Vapor Pressures of (R)-Deprenyl, (S)-Benzphetamine, Alverine, and a Series of Aliphatic Tertiary Amines by Correlation Gas Chromatography at T/K = 298.15
Pvap	0.95	kPa	308.15	Evaluation of the Vaporization Enthalpies and Liquid Vapor Pressures of (R)-Deprenyl, (S)-Benzphetamine, Alverine, and a Series of Aliphatic Tertiary Amines by Correlation Gas Chromatography at T/K = 298.15
Pvap	1.26	kPa	313.15	Evaluation of the Vaporization Enthalpies and Liquid Vapor Pressures of (R)-Deprenyl, (S)-Benzphetamine, Alverine, and a Series of Aliphatic Tertiary Amines by Correlation Gas Chromatography at T/K = 298.15
ρl	[740.41; 752.10]	kg/m3	[298.15; 313.15]
ρl	752.10	kg/m3	298.15	Partial molar volume of tertiary amines in methanol at T = 298.15 K. Solvation, shape and specific interactions
ρl	749.15	kg/m3	303.15	Studies of partial molar volumes of alkylamine in non-electrolyte solvents I. Alkylamines in hydrocarbons at 303.15 and 313.15K
ρl	749.15	kg/m3	303.15	Studies of viscosities of dilute solutions of alkylamines in non-electrolyte solvents III. Alkylamines in butanols 303.15K
ρl	740.41	kg/m3	313.15	Studies of partial molar volumes of alkylamine in non-electrolyte solvents I. Alkylamines in hydrocarbons at 303.15 and 313.15K

Datasets

Viscosity, Pa*s

Fixed		Measured
Temperature, K - Liquid	Pressure, kPa - Liquid	Viscosity, Pa*s - Liquid
303.15	101.33	0.0006
Reference

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.66]	kPa	[325.72; 453.50]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.57356e+01
Coefficient B			-4.09570e+03
Coefficient C			-6.05930e+01
Temperature range, min.			325.72
Temperature range, max.			453.50
Pvap	1.33	kPa	325.72	Calculated Property
Pvap	2.92	kPa	339.92	Calculated Property
Pvap	5.94	kPa	354.12	Calculated Property
Pvap	11.31	kPa	368.31	Calculated Property
Pvap	20.35	kPa	382.51	Calculated Property
Pvap	34.82	kPa	396.71	Calculated Property
Pvap	57.06	kPa	410.91	Calculated Property
Pvap	89.97	kPa	425.10	Calculated Property
Pvap	137.11	kPa	439.30	Calculated Property
Pvap	202.66	kPa	453.50	Calculated Property
Pvap	[2.00e-08; 2115.04]	kPa	[179.65; 577.50]	KDB Vapor Pressure Data
Equation			ln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A			1.04659e+02
Coefficient B			-1.01020e+04
Coefficient C			-1.27761e+01
Coefficient D			5.18581e-06
Temperature range, min.			179.65
Temperature range, max.			577.50
Pvap	2.00e-08	kPa	179.65	Calculated Property
Pvap	8.79e-05	kPa	223.86	Calculated Property
Pvap	0.02	kPa	268.06	Calculated Property
Pvap	0.57	kPa	312.27	Calculated Property
Pvap	6.71	kPa	356.47	Calculated Property
Pvap	40.88	kPa	400.68	Calculated Property
Pvap	159.57	kPa	444.88	Calculated Property
Pvap	458.82	kPa	489.09	Calculated Property
Pvap	1063.82	kPa	533.29	Calculated Property
Pvap	2115.04	kPa	577.50	Calculated Property

Similar Compounds

Find more compounds similar to 1-Propanamine, N,N-dipropyl-.

Mixtures

• 1-Propanamine, N,N-dipropyl- + Methyl Alcohol
• 1-Propanamine, N,N-dipropyl- + Carbon Tetrachloride
• Trichloromethane + 1-Propanamine, N,N-dipropyl-
• 1-Propanamine, N,N-dipropyl- + Cyclohexane
• Benzene + 1-Propanamine, N,N-dipropyl-
• 1-Propanamine, N,N-dipropyl- + 1-Butanol
• 1-Propanamine, N,N-dipropyl- + 1,4-Dioxane
• 1-Propanamine, N,N-dipropyl- + Tetrahydrofuran
• 1-Propanamine, N,N-dipropyl- + Heptane

Sources

• KDB Vapor Pressure Data
• Cheméo Relay (1.0)
• Crippen Method
• Thermodynamic study of (heptane + amine) mixtures. III: Excess and partial molar volumes in mixtures with secondary, tertiary, and cyclic amines at 298.15 K
• Partial molar volume of tertiary amines in methanol at T = 298.15 K. Solvation, shape and specific interactions
• Studies of viscosities of dilute solutions of alkylamine in non-electrolyte solvents. II. Haloalkanes and other polar solvents
• Studies of partial molar volumes of alkylamine in non-electrolyte solvents I. Alkylamines in hydrocarbons at 303.15 and 313.15K
• Studies of viscosities of dilute solutions of alkylamines in non-electrolyte solvents III. Alkylamines in butanols 303.15K
• Studies of viscosities of dilute solutions of alkylamines in non-electrolyte solvents: IV. Alkylamines in 1,4-dioxane and oxolane at 303.15K
• Evaluation of the Vaporization Enthalpies and Liquid Vapor Pressures of (R)-Deprenyl, (S)-Benzphetamine, Alverine, and a Series of Aliphatic Tertiary Amines by Correlation Gas Chromatography at T/K = 298.15
• Joback Method
• KDB
• Aqueous Solubility Prediction Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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