ChemSpider 2D Image | Methyl 2-{[(2,4-dimethyl-3-cyclohexen-1-yl)methylene]amino}benzoate | C17H21NO2

Methyl 2-{[(2,4-dimethyl-3-cyclohexen-1-yl)methylene]amino}benzoate

  • Molecular FormulaC17H21NO2
  • Average mass271.354 Da
  • Monoisotopic mass271.157227 Da
  • ChemSpider ID21167887

More details:

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

2-{[(2,4-Diméthyl-3-cyclohexén-1-yl)méthylène]amino}benzoate de méthyle [French] [ACD/IUPAC Name]
272-449-2 [EINECS]
Benzoic acid, 2-[[(2,4-dimethyl-3-cyclohexen-1-yl)methylene]amino]-, methyl ester [ACD/Index Name]
Methyl 2-{[(2,4-dimethyl-3-cyclohexen-1-yl)methylene]amino}benzoate [ACD/IUPAC Name]
Methyl 2-{[(2,4-dimethylcyclohex-3-en-1-yl)methylene]amino}benzoate
Methyl-2-{[(2,4-dimethyl-3-cyclohexen-1-yl)methylen]amino}benzoat [German] [ACD/IUPAC Name]
68845-02-3 [RN]
methyl 2-[[(2,4-dimethyl-3-cyclohexen-1-yl)methylene]amino]benzoate
METHYL 2-{[(2,4-DIMETHYLCYCLOHEX-3-EN-1-YL)METHYLIDENE]AMINO}BENZOATE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 404.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.6±3.0 kJ/mol
Flash Point: 165.0±23.2 °C
Index of Refraction: 1.544
Molar Refractivity: 80.5±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.53
ACD/LogD (pH 5.5): 4.88
ACD/BCF (pH 5.5): 2971.20
ACD/KOC (pH 5.5): 10579.99
ACD/LogD (pH 7.4): 4.89
ACD/BCF (pH 7.4): 3044.20
ACD/KOC (pH 7.4): 10839.92
Polar Surface Area: 39 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 35.6±7.0 dyne/cm
Molar Volume: 255.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement