ChemSpider 2D Image | Ethyl 3-{[(2-isopropyl-5-methylcyclohexyl)carbamoyl]amino}butanoate | C17H32N2O3

Ethyl 3-{[(2-isopropyl-5-methylcyclohexyl)carbamoyl]amino}butanoate

  • Molecular FormulaC17H32N2O3
  • Average mass312.448 Da
  • Monoisotopic mass312.241302 Da
  • ChemSpider ID28475395

More details:

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

3-{[(2-Isopropyl-5-méthylcyclohexyl)carbamoyl]amino}butanoate d'éthyle [French] [ACD/IUPAC Name]
Butanoic acid, 3-[[[[5-methyl-2-(1-methylethyl)cyclohexyl]amino]carbonyl]amino]-, ethyl ester [ACD/Index Name]
Ethyl 3-[[[[5-methyl-2-(1-methylethyl)cyclohexyl]amino]carbonyl]amino]butanoate
Ethyl 3-{[(2-isopropyl-5-methylcyclohexyl)carbamoyl]amino}butanoate [ACD/IUPAC Name]
Ethyl-3-{[(2-isopropyl-5-methylcyclohexyl)carbamoyl]amino}butanoat [German] [ACD/IUPAC Name]
L6TJ AY1&1 BMVMY1&1VO2 D1 [WLN]
FEMA 4766

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

Density: 1.0±0.1 g/cm3
Boiling Point: 460.2±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.1±3.0 kJ/mol
Flash Point: 232.1±22.9 °C
Index of Refraction: 1.482
Molar Refractivity: 87.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.05
ACD/LogD (pH 5.5): 4.20
ACD/BCF (pH 5.5): 922.48
ACD/KOC (pH 5.5): 4612.29
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 922.47
ACD/KOC (pH 7.4): 4612.24
Polar Surface Area: 67 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 36.6±5.0 dyne/cm
Molar Volume: 308.3±5.0 cm3

Click to predict properties on the Chemicalize site


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