ChemSpider 2D Image | N-Acetyl-S-[(4-bromophenyl)carbamoyl]-L-cysteine | C12H13BrN2O4S

N-Acetyl-S-[(4-bromophenyl)carbamoyl]-L-cysteine

  • Molecular FormulaC12H13BrN2O4S
  • Average mass361.212 Da
  • Monoisotopic mass359.977936 Da
  • ChemSpider ID26379293

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Cysteine, N-acetyl-S-[[(4-bromophenyl)amino]carbonyl]- [ACD/Index Name]
N-Acetyl-S-[(4-bromophenyl)carbamoyl]-L-cysteine [ACD/IUPAC Name]
N-Acétyl-S-[(4-bromophényl)carbamoyl]-L-cystéine [French] [ACD/IUPAC Name]
N-Acetyl-S-[(4-bromphenyl)carbamoyl]-L-cystein [German] [ACD/IUPAC Name]
1262526-88-4 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.648
Molar Refractivity: 79.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.91
ACD/LogD (pH 5.5): -0.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.85
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 121 Å2
Polarizability: 31.7±0.5 10-24cm3
Surface Tension: 64.9±3.0 dyne/cm
Molar Volume: 219.6±3.0 cm3

Click to predict properties on the Chemicalize site


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