ChemSpider 2D Image | N-Acetyl-S-(1,1-dichloro-2,2-difluoroethyl)cysteine | C7H9Cl2F2NO3S

N-Acetyl-S-(1,1-dichloro-2,2-difluoroethyl)cysteine

  • Molecular FormulaC7H9Cl2F2NO3S
  • Average mass296.119 Da
  • Monoisotopic mass294.964813 Da
  • ChemSpider ID23254670

More details:

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

Cysteine, N-acetyl-S-(1,1-dichloro-2,2-difluoroethyl)- [ACD/Index Name]
N-Acetyl-S-(1,1-dichlor-2,2-difluorethyl)cystein [German] [ACD/IUPAC Name]
N-Acetyl-S-(1,1-dichloro-2,2-difluoroethyl)cysteine [ACD/IUPAC Name]
N-Acétyl-S-(1,1-dichloro-2,2-difluoroéthyl)cystéine [French] [ACD/IUPAC Name]
112761-86-1 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 428.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 75.0±6.0 kJ/mol
Flash Point: 213.1±28.7 °C
Index of Refraction: 1.508
Molar Refractivity: 57.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.23
ACD/LogD (pH 5.5): -1.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 22.8±0.5 10-24cm3
Surface Tension: 45.7±3.0 dyne/cm
Molar Volume: 193.1±3.0 cm3

Click to predict properties on the Chemicalize site


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