ChemSpider 2D Image | Methyl 1-benzylcyclopentanecarboxylate | C14H18O2

Methyl 1-benzylcyclopentanecarboxylate

  • Molecular FormulaC14H18O2
  • Average mass218.292 Da
  • Monoisotopic mass218.130676 Da
  • ChemSpider ID28289938

More details:

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

1-Benzylcyclopentanecarboxylate de méthyle [French] [ACD/IUPAC Name]
Cyclopentanecarboxylic acid, 1-(phenylmethyl)-, methyl ester [ACD/Index Name]
Methyl 1-benzylcyclopentanecarboxylate [ACD/IUPAC Name]
Methyl-1-benzylcyclopentancarboxylat [German] [ACD/IUPAC Name]
[784182-12-3] [RN]
5-(2,4-dimethoxyphenyl)cyclohexane-1,3-dione
784182-12-3 [RN]
'784182-12-3 [EINECS]
Methyl 1-benzylcyclopentane-1-carboxylate
Methyl1-benzylcyclopentanecarboxylate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 295.6±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.5±3.0 kJ/mol
Flash Point: 125.0±6.3 °C
Index of Refraction: 1.534
Molar Refractivity: 63.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.76
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 455.18
ACD/KOC (pH 5.5): 2781.82
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 455.18
ACD/KOC (pH 7.4): 2781.82
Polar Surface Area: 26 Å2
Polarizability: 25.0±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 203.1±3.0 cm3

Click to predict properties on the Chemicalize site


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