ChemSpider 2D Image | 1,2,2-Trimethyl-3-cyclopentene-1-carboxylic acid | C9H14O2

1,2,2-Trimethyl-3-cyclopentene-1-carboxylic acid

  • Molecular FormulaC9H14O2
  • Average mass154.206 Da
  • Monoisotopic mass154.099380 Da
  • ChemSpider ID26286972

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1,2,2-Trimethyl-3-cyclopenten-1-carbonsäure [German] [ACD/IUPAC Name]
1,2,2-Trimethyl-3-cyclopentene-1-carboxylic acid [ACD/IUPAC Name]
3-Cyclopentene-1-carboxylic acid, 1,2,2-trimethyl- [ACD/Index Name]
Acide 1,2,2-triméthyl-3-cyclopentène-1-carboxylique [French] [ACD/IUPAC Name]
1,2,2-trimethylcyclopent-3-ene-1-carboxylic acid
21733-78-8 [RN]
MFCD20638259

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 230.7±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 51.5±6.0 kJ/mol
Flash Point: 110.2±13.4 °C
Index of Refraction: 1.477
Molar Refractivity: 42.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.51
ACD/LogD (pH 5.5): 1.32
ACD/BCF (pH 5.5): 3.75
ACD/KOC (pH 5.5): 52.17
ACD/LogD (pH 7.4): -0.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 16.9±0.5 10-24cm3
Surface Tension: 33.4±3.0 dyne/cm
Molar Volume: 151.1±3.0 cm3

Click to predict properties on the Chemicalize site






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