ChemSpider 2D Image | N-Acetyl-S-(2-chloro-2-propen-1-yl)cysteine | C8H12ClNO3S

N-Acetyl-S-(2-chloro-2-propen-1-yl)cysteine

  • Molecular FormulaC8H12ClNO3S
  • Average mass237.704 Da
  • Monoisotopic mass237.022644 Da
  • ChemSpider ID44305609

More details:

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

Cysteine, N-acetyl-S-(2-chloro-2-propen-1-yl)- [ACD/Index Name]
N-Acetyl-S-(2-chlor-2-propen-1-yl)cystein [German] [ACD/IUPAC Name]
N-Acetyl-S-(2-chloro-2-propen-1-yl)cysteine [ACD/IUPAC Name]
N-Acétyl-S-(2-chloro-2-propén-1-yl)cystéine [French] [ACD/IUPAC 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: 473.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 80.7±6.0 kJ/mol
Flash Point: 240.3±28.7 °C
Index of Refraction: 1.536
Molar Refractivity: 56.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.60
ACD/LogD (pH 5.5): -1.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 47.4±3.0 dyne/cm
Molar Volume: 181.8±3.0 cm3

Click to predict properties on the Chemicalize site


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