Chemical Properties of 4-Octene, 2,6-dimethyl-, [S-(E)]- (CAS 62960-76-3)

InChI

InChI=1S/C10H20/c1-5-10(4)8-6-7-9(2)3/h6,8-10H,5,7H2,1-4H3/b8-6+/t10-/m1/s1

InChI Key

PBPBSFCZFRLBFJ-QEHWCHDUSA-N

Formula

C10H20

SMILES

CCC(C)C=CCC(C)C

Molecular Weight¹

140.27

CAS

62960-76-3

Other Names

• (S,E)-2,6-Dimethyloct-4-ene

• 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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	[202.99; 505.73]	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			-2.37480e+01
Coefficient B			9.85680e-01
Coefficient C			-6.10400e-04
Coefficient D			1.54200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	202.99	J/mol×K	273.00	Calculated Property
Cp,gas	255.39	J/mol×K	353.78	Calculated Property
Cp,gas	301.97	J/mol×K	434.56	Calculated Property
Cp,gas	343.21	J/mol×K	515.33	Calculated Property
Cp,gas	379.59	J/mol×K	596.11	Calculated Property
Cp,gas	411.60	J/mol×K	676.89	Calculated Property
Cp,gas	439.73	J/mol×K	757.67	Calculated Property
Cp,gas	464.47	J/mol×K	838.44	Calculated Property
Cp,gas	486.31	J/mol×K	919.22	Calculated Property
Cp,gas	505.73	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0212319; 0.0001865]	Pa×s	[167.38; 426.74]	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			-1.16424e+01
Coefficient B			1.30392e+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.			167.38
Temperature range, max.			426.74
η	0.0212319	Pa×s	167.38	Calculated Property
η	0.0067617	Pa×s	196.20	Calculated Property
η	0.0028867	Pa×s	225.02	Calculated Property
η	0.0014952	Pa×s	253.83	Calculated Property
η	0.0008856	Pa×s	282.65	Calculated Property
η	0.0005779	Pa×s	311.47	Calculated Property
η	0.0004054	Pa×s	340.29	Calculated Property
η	0.0003006	Pa×s	369.10	Calculated Property
η	0.0002327	Pa×s	397.92	Calculated Property
η	0.0001865	Pa×s	426.74	Calculated Property

Similar Compounds

Find more compounds similar to 4-Octene, 2,6-dimethyl-, [S-(E)]-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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