Chemical Properties of 3,7,11,15-Tetramethyl-2-hexadecen-1-ol

InChI

InChI=1S/C20H40O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h15,17-19,21H,6-14,16H2,1-5H3

InChI Key

BOTWFXYSPFMFNR-UHFFFAOYSA-N

Formula

C20H40O

SMILES

CC(=CCO)CCCC(C)CCCC(C)CCCC(C)C

Molecular Weight¹

296.54

Other Names

• 2-Hexadecen-1-ol, 3,7,11,15-tetramethyl

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• 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.
• 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	0.8980		Relay (1.0) Calculated Property
ΔfusH°	39.97	kJ/mol	Joback Calculated Property
ΔvapH°	112.02	kJ/mol	Relay (1.0) Calculated Property
log10WS	-6.99		Relay (1.0) Calculated Property
logPoct/wat	6.364		Crippen Calculated Property
McVol	294.230	ml/mol	McGowan Calculated Property
Pc	1137.50	kPa	Joback Calculated Property
Inp	[2114.00; 2119.33]
Inp	2119.33		NIST
Inp	2116.00		NIST
Inp	2114.00		NIST
Inp	2119.33		NIST
Tboil	612.67	K	Relay (1.0) Calculated Property
Tc	793.58	K	Relay (1.0) Calculated Property
Tfus	261.58	K	Relay (1.0) Calculated Property
Vc	1.062	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[427.46; 1040.58]	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			-2.89200e+01
Coefficient B			1.97550e+00
Coefficient C			-1.19030e-03
Coefficient D			2.84300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	427.46	J/mol×K	273.00	Calculated Property
Cp,gas	533.58	J/mol×K	353.78	Calculated Property
Cp,gas	628.10	J/mol×K	434.56	Calculated Property
Cp,gas	711.92	J/mol×K	515.33	Calculated Property
Cp,gas	785.95	J/mol×K	596.11	Calculated Property
Cp,gas	851.08	J/mol×K	676.89	Calculated Property
Cp,gas	908.20	J/mol×K	757.67	Calculated Property
Cp,gas	958.23	J/mol×K	838.44	Calculated Property
Cp,gas	1002.06	J/mol×K	919.22	Calculated Property
Cp,gas	1040.58	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 3,7,11,15-Tetramethyl-2-hexadecen-1-ol.

Sources

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

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