ChemSpider 2D Image | 3-Cyclohexen-1-ylmethyl 3-[(4-methoxyphenyl)sulfonyl]-2-methylpropanoate | C18H24O5S

3-Cyclohexen-1-ylmethyl 3-[(4-methoxyphenyl)sulfonyl]-2-methylpropanoate

  • Molecular FormulaC18H24O5S
  • Average mass352.445 Da
  • Monoisotopic mass352.134430 Da
  • ChemSpider ID32005460

More details:

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

3-[(4-Méthoxyphényl)sulfonyl]-2-méthylpropanoate de 3-cyclohexén-1-ylméthyle [French] [ACD/IUPAC Name]
3-Cyclohexen-1-ylmethyl 3-[(4-methoxyphenyl)sulfonyl]-2-methylpropanoate [ACD/IUPAC Name]
3-Cyclohexen-1-ylmethyl-3-[(4-methoxyphenyl)sulfonyl]-2-methylpropanoat [German] [ACD/IUPAC Name]
Propanoic acid, 3-[(4-methoxyphenyl)sulfonyl]-2-methyl-, 3-cyclohexen-1-ylmethyl ester [ACD/Index Name]
(CYCLOHEX-3-EN-1-YL)METHYL 3-(4-METHOXYBENZENESULFONYL)-2-METHYLPROPANOATE
CYCLOHEX-3-EN-1-YLMETHYL 3-(4-METHOXYBENZENESULFONYL)-2-METHYLPROPANOATE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 514.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±3.0 kJ/mol
Flash Point: 265.2±30.1 °C
Index of Refraction: 1.527
Molar Refractivity: 92.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.81
ACD/LogD (pH 5.5): 3.05
ACD/BCF (pH 5.5): 122.87
ACD/KOC (pH 5.5): 1089.53
ACD/LogD (pH 7.4): 3.05
ACD/BCF (pH 7.4): 122.87
ACD/KOC (pH 7.4): 1089.53
Polar Surface Area: 78 Å2
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 41.2±3.0 dyne/cm
Molar Volume: 300.9±3.0 cm3

Click to predict properties on the Chemicalize site


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