Chemical Properties of 4-Octene, 2,3,6-trimethyl-

InChI

InChI=1S/C11H22/c1-6-10(4)7-8-11(5)9(2)3/h7-11H,6H2,1-5H3/b8-7+

InChI Key

BPHPRVXZLWQTOR-BQYQJAHWSA-N

Formula

C11H22

SMILES

CCC(C)/C=C/C(C)C(C)C

Molecular Weight¹

154.30

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• 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

Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Log10 of Water solubility in mol/l 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	[223.89; 557.86]	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			-2.63390e+01
Coefficient B			1.08660e+00
Coefficient C			-6.68000e-04
Coefficient D			1.65600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	223.89	J/mol×K	273.00	Calculated Property
Cp,gas	281.80	J/mol×K	353.78	Calculated Property
Cp,gas	333.29	J/mol×K	434.56	Calculated Property
Cp,gas	378.89	J/mol×K	515.33	Calculated Property
Cp,gas	419.10	J/mol×K	596.11	Calculated Property
Cp,gas	454.46	J/mol×K	676.89	Calculated Property
Cp,gas	485.50	J/mol×K	757.67	Calculated Property
Cp,gas	512.73	J/mol×K	838.44	Calculated Property
Cp,gas	536.67	J/mol×K	919.22	Calculated Property
Cp,gas	557.86	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0447839; 0.0001755]	Pa×s	[163.65; 444.21]	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			-1.18801e+01
Coefficient B			1.43590e+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.			163.65
Temperature range, max.			444.21
η	0.0447839	Pa×s	163.65	Calculated Property
η	0.0110001	Pa×s	194.82	Calculated Property
η	0.0039800	Pa×s	226.00	Calculated Property
η	0.0018425	Pa×s	257.17	Calculated Property
η	0.0010075	Pa×s	288.34	Calculated Property
η	0.0006198	Pa×s	319.52	Calculated Property
η	0.0004157	Pa×s	350.69	Calculated Property
η	0.0002976	Pa×s	381.86	Calculated Property
η	0.0002240	Pa×s	413.04	Calculated Property
η	0.0001755	Pa×s	444.21	Calculated Property

Similar Compounds

Find more compounds similar to 4-Octene, 2,3,6-trimethyl-.

Sources

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

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