Chemical Properties of 1,9-Decadiene (CAS 1647-16-1)

InChI

InChI=1S/C10H18/c1-3-5-7-9-10-8-6-4-2/h3-4H,1-2,5-10H2

InChI Key

NLDGJRWPPOSWLC-UHFFFAOYSA-N

Formula

C10H18

SMILES

C=CCCCCCCC=C

Molecular Weight¹

138.25

CAS

1647-16-1

Other Names

• Decadiene-1,9

• ω : Acentric Factor.
• 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_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (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).
• I_np : Non-polar retention indices.
• I_p : 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	0.4279		Relay (1.0) Calculated Property
ΔfG°	209.00	kJ/mol	Joback Calculated Property
ΔfH°gas	-48.97	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	19.10	kJ/mol	Joback Calculated Property
ΔvapH°	51.35	kJ/mol	Relay (1.0) Calculated Property
IE	9.29	eV	Relay (1.0) Calculated Property
log10WS	-4.97		Relay (1.0) Calculated Property
logPoct/wat	3.699		Crippen Calculated Property
McVol	143.160	ml/mol	McGowan Calculated Property
Pc	2280.59	kPa	Joback Calculated Property
Inp	[964.00; 983.00]
Inp	964.00		NIST
Inp	966.00		NIST
Inp	978.00		NIST
Inp	983.00		NIST
Inp	978.00		NIST
Inp	978.00		NIST
Ip	1160.00		NIST
Tboil	[438.00; 442.20]	K
Tboil	442.20	K	NIST
Tboil	438.00 ± 1.50	K	NIST
Tboil	438.00 ± 2.00	K	NIST
Tc	622.44	K	Relay (1.0) Calculated Property
Tfus	224.74	K	Relay (1.0) Calculated Property
Vc	0.534	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[198.00; 478.22]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.21840e+01
Coefficient B			9.13800e-01
Coefficient C			-5.66000e-04
Coefficient D			1.42600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	198.00	J/mol×K	273.00	Calculated Property
Cp,gas	246.57	J/mol×K	353.78	Calculated Property
Cp,gas	289.73	J/mol×K	434.56	Calculated Property
Cp,gas	327.93	J/mol×K	515.33	Calculated Property
Cp,gas	361.62	J/mol×K	596.11	Calculated Property
Cp,gas	391.25	J/mol×K	676.89	Calculated Property
Cp,gas	417.28	J/mol×K	757.67	Calculated Property
Cp,gas	440.15	J/mol×K	838.44	Calculated Property
Cp,gas	460.31	J/mol×K	919.22	Calculated Property
Cp,gas	478.22	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0045600; 0.0002445]	Pa×s	[198.94; 413.51]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.10289e+01
Coefficient B			1.12172e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			198.94
Temperature range, max.			413.51
η	0.0045600	Pa×s	198.94	Calculated Property
η	0.0024941	Pa×s	222.78	Calculated Property
η	0.0015329	Pa×s	246.62	Calculated Property
η	0.0010266	Pa×s	270.46	Calculated Property
η	0.0007336	Pa×s	294.31	Calculated Property
η	0.0005514	Pa×s	318.15	Calculated Property
η	0.0004312	Pa×s	341.99	Calculated Property
η	0.0003482	Pa×s	365.83	Calculated Property
η	0.0002887	Pa×s	389.67	Calculated Property
η	0.0002445	Pa×s	413.51	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[333.62; 468.24]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.53917e+01
Coefficient B			-4.07973e+03
Coefficient C			-6.35120e+01
Temperature range, min.			333.62
Temperature range, max.			468.24
Pvap	1.33	kPa	333.62	Calculated Property
Pvap	2.95	kPa	348.58	Calculated Property
Pvap	6.01	kPa	363.54	Calculated Property
Pvap	11.47	kPa	378.49	Calculated Property
Pvap	20.63	kPa	393.45	Calculated Property
Pvap	35.26	kPa	408.41	Calculated Property
Pvap	57.66	kPa	423.37	Calculated Property
Pvap	90.64	kPa	438.32	Calculated Property
Pvap	137.64	kPa	453.28	Calculated Property
Pvap	202.65	kPa	468.24	Calculated Property

Similar Compounds

Find more compounds similar to 1,9-Decadiene.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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