Chemical Properties of trans-2-Isopropylbicylclo[4.3.0]non-3-ene-8-one

InChI

InChI=1S/C12H18O/c1-8(2)11-5-3-4-9-6-10(13)7-12(9)11/h3,5,8-9,11-12H,4,6-7H2,1-2H3

InChI Key

MNCSLWSQTFQICJ-UHFFFAOYSA-N

Formula

C12H18O

SMILES

CC(C)C1C=CCC2CC(=O)CC21

Molecular Weight¹

178.27

Other Names

• Trans-2-isopropyl-bicyclo-[4,3,0]-non-3-ene-8-one

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[405.35; 514.05]	J/mol×K	[562.12; 791.49]
Cp,gas	405.35	J/mol×K	562.12	Joback Calculated Property
Cp,gas	426.54	J/mol×K	600.35	Joback Calculated Property
Cp,gas	446.45	J/mol×K	638.58	Joback Calculated Property
Cp,gas	465.12	J/mol×K	676.81	Joback Calculated Property
Cp,gas	482.59	J/mol×K	715.03	Joback Calculated Property
Cp,gas	498.88	J/mol×K	753.26	Joback Calculated Property
Cp,gas	514.05	J/mol×K	791.49	Joback Calculated Property

Similar Compounds

Find more compounds similar to trans-2-Isopropylbicylclo[4.3.0]non-3-ene-8-one.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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