ChemSpider 2D Image | 2-Methyl-2-propanyl [(2S)-2-amino-2-(3-bromophenyl)ethyl]carbamate | C13H19BrN2O2

2-Methyl-2-propanyl [(2S)-2-amino-2-(3-bromophenyl)ethyl]carbamate

  • Molecular FormulaC13H19BrN2O2
  • Average mass315.206 Da
  • Monoisotopic mass314.062988 Da
  • ChemSpider ID110612437

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[(2S)-2-Amino-2-(3-bromophényl)éthyl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [(2S)-2-amino-2-(3-bromophenyl)ethyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[(2S)-2-amino-2-(3-bromphenyl)ethyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[(2S)-2-amino-2-(3-bromophenyl)ethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 424.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.9±3.0 kJ/mol
Flash Point: 210.6±27.3 °C
Index of Refraction: 1.548
Molar Refractivity: 75.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.15
ACD/LogD (pH 5.5): -0.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.38
ACD/LogD (pH 7.4): 1.59
ACD/BCF (pH 7.4): 5.72
ACD/KOC (pH 7.4): 67.03
Polar Surface Area: 64 Å2
Polarizability: 29.9±0.5 10-24cm3
Surface Tension: 43.0±3.0 dyne/cm
Molar Volume: 237.7±3.0 cm3

Click to predict properties on the Chemicalize site


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