ChemSpider 2D Image | N-Acetyl-S-[(Z)-1,2-dichlorovinyl]-D-cysteine | C7H9Cl2NO3S

N-Acetyl-S-[(Z)-1,2-dichlorovinyl]-D-cysteine

  • Molecular FormulaC7H9Cl2NO3S
  • Average mass258.122 Da
  • Monoisotopic mass256.968018 Da
  • ChemSpider ID77498687

  • Double-bond stereo - Double-bond stereo

    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-[(Z)-1,2-dichloroethenyl]- [ACD/Index Name]
N-Acetyl-S-[(Z)-1,2-dichlorovinyl]-D-cysteine [ACD/IUPAC Name]
N-Acétyl-S-[(Z)-1,2-dichlorovinyl]-D-cystéine [French] [ACD/IUPAC Name]
N-Acetyl-S-[(Z)-1,2-dichlorvinyl]-D-cystein [German] [ACD/IUPAC Name]
147526-32-7 [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: 478.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 81.4±6.0 kJ/mol
Flash Point: 243.2±28.7 °C
Index of Refraction: 1.567
Molar Refractivity: 57.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.44
ACD/LogD (pH 5.5): -0.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 22.7±0.5 10-24cm3
Surface Tension: 53.5±3.0 dyne/cm
Molar Volume: 175.2±3.0 cm3

Click to predict properties on the Chemicalize site


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