Chemical Properties of 1,15-Hexadecadiene (CAS 21964-51-2)

InChI

InChI=1S/C16H30/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3-4H,1-2,5-16H2

InChI Key

JEJVUMPKJVMOEZ-UHFFFAOYSA-N

Formula

C16H30

SMILES

C=CCCCCCCCCCCCCC=C

Molecular Weight¹

222.41

CAS

21964-51-2

Other Names

• Hexadecadiene-1,15

• 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).
• 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	0.6682		Relay (1.0) Calculated Property
ΔfG°	259.52	kJ/mol	Joback Calculated Property
ΔfH°gas	-183.37	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	34.64	kJ/mol	Joback Calculated Property
ΔvapH°	80.33	kJ/mol	Relay (1.0) Calculated Property
IE	9.31	eV	Relay (1.0) Calculated Property
log10WS	-6.85		Relay (1.0) Calculated Property
logPoct/wat	6.040		Crippen Calculated Property
McVol	227.700	ml/mol	McGowan Calculated Property
Pc	1402.74	kPa	Joback Calculated Property
Inp	[1577.00; 1581.00]
Inp	1577.00		NIST
Inp	1581.00		NIST
Inp	1581.00		NIST
I	1708.00		NIST
Tboil	550.06	K	Relay (1.0) Calculated Property
Tc	719.14	K	Relay (1.0) Calculated Property
Tfus	279.36	K	Relay (1.0) Calculated Property
Vc	0.872	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[325.28; 787.76]	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			-1.76380e+01
Coefficient B			1.48380e+00
Coefficient C			-8.92400e-04
Coefficient D			2.14000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	325.28	J/mol×K	273.00	Calculated Property
Cp,gas	405.08	J/mol×K	353.78	Calculated Property
Cp,gas	476.20	J/mol×K	434.56	Calculated Property
Cp,gas	539.31	J/mol×K	515.33	Calculated Property
Cp,gas	595.09	J/mol×K	596.11	Calculated Property
Cp,gas	644.22	J/mol×K	676.89	Calculated Property
Cp,gas	687.38	J/mol×K	757.67	Calculated Property
Cp,gas	725.23	J/mol×K	838.44	Calculated Property
Cp,gas	758.47	J/mol×K	919.22	Calculated Property
Cp,gas	787.76	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0044277; 0.0002222]	Pa×s	[266.56; 505.70]	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			-1.17475e+01
Coefficient B			1.68668e+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.			266.56
Temperature range, max.			505.70
η	0.0044277	Pa×s	266.56	Calculated Property
η	0.0024951	Pa×s	293.13	Calculated Property
η	0.0015466	Pa×s	319.70	Calculated Property
η	0.0010317	Pa×s	346.27	Calculated Property
η	0.0007291	Pa×s	372.84	Calculated Property
η	0.0005397	Pa×s	399.42	Calculated Property
η	0.0004147	Pa×s	425.99	Calculated Property
η	0.0003287	Pa×s	452.56	Calculated Property
η	0.0002673	Pa×s	479.13	Calculated Property
η	0.0002222	Pa×s	505.70	Calculated Property

Similar Compounds

Find more compounds similar to 1,15-Hexadecadiene.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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