ChemSpider 2D Image | N-Acetyl-S-(4-nitrophenyl)-D-cysteine | C11H12N2O5S

N-Acetyl-S-(4-nitrophenyl)-D-cysteine

  • Molecular FormulaC11H12N2O5S
  • Average mass284.288 Da
  • Monoisotopic mass284.046692 Da
  • ChemSpider ID57425980

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

D-Cysteine, N-acetyl-S-(4-nitrophenyl)- [ACD/Index Name]
N-Acetyl-S-(4-nitrophenyl)-D-cystein [German] [ACD/IUPAC Name]
N-Acetyl-S-(4-nitrophenyl)-D-cysteine [ACD/IUPAC Name]
N-Acétyl-S-(4-nitrophényl)-D-cystéine [French] [ACD/IUPAC Name]
91088-55-0 [RN]
N-Acetyl-3-[(p-nitrophenyl)thio]alanine
N-Acetyl-S-(4-nitrophenyl)-L-cysteine [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 582.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.6±3.0 kJ/mol
Flash Point: 306.1±30.1 °C
Index of Refraction: 1.618
Molar Refractivity: 69.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.46
ACD/LogD (pH 5.5): -1.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 138 Å2
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 67.4±5.0 dyne/cm
Molar Volume: 197.9±5.0 cm3

Click to predict properties on the Chemicalize site


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