Chemical Properties of Benzene, 1,2,3-trimethyl-4-(2-propenyl)

InChI

InChI=1S/C12H16/c1-5-6-12-8-7-9(2)10(3)11(12)4/h5,7-8H,1,6H2,2-4H3

InChI Key

PVXQYHVKWFSLLL-UHFFFAOYSA-N

Formula

C12H16

SMILES

C=CCc1ccc(C)c(C)c1C

Molecular Weight¹

160.26

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• 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, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[328.77; 409.00]	J/mol×K	[512.26; 719.31]
Cp,gas	328.77	J/mol×K	512.26	Joback Calculated Property
Cp,gas	343.96	J/mol×K	546.77	Joback Calculated Property
Cp,gas	358.38	J/mol×K	581.28	Joback Calculated Property
Cp,gas	372.07	J/mol×K	615.79	Joback Calculated Property
Cp,gas	385.06	J/mol×K	650.29	Joback Calculated Property
Cp,gas	397.36	J/mol×K	684.80	Joback Calculated Property
Cp,gas	409.00	J/mol×K	719.31	Joback Calculated Property
η	[0.0001900; 0.0012949]	Pa×s	[287.22; 512.26]
η	0.0012949	Pa×s	287.22	Joback Calculated Property
η	0.0007818	Pa×s	324.73	Joback Calculated Property
η	0.0005240	Pa×s	362.23	Joback Calculated Property
η	0.0003786	Pa×s	399.74	Joback Calculated Property
η	0.0002892	Pa×s	437.25	Joback Calculated Property
η	0.0002305	Pa×s	474.75	Joback Calculated Property
η	0.0001900	Pa×s	512.26	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzene, 1,2,3-trimethyl-4-(2-propenyl).

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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