ChemSpider 2D Image | S-Cyano-L-cysteine | C4H6N2O2S

S-Cyano-L-cysteine

  • Molecular FormulaC4H6N2O2S
  • Average mass146.168 Da
  • Monoisotopic mass146.014999 Da
  • ChemSpider ID32969944

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Cysteine, S-cyano- [ACD/Index Name]
S-Cyan-L-cystein [German] [ACD/IUPAC Name]
S-Cyano-L-cysteine [ACD/IUPAC Name]
S-Cyano-L-cystéine [French] [ACD/IUPAC Name]
??-Thiocyanoalanin
256483-60-0 [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: 346.3±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 64.9±6.0 kJ/mol
Flash Point: 163.2±26.5 °C
Index of Refraction: 1.582
Molar Refractivity: 33.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.16
ACD/LogD (pH 5.5): -2.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 112 Å2
Polarizability: 13.3±0.5 10-24cm3
Surface Tension: 77.5±3.0 dyne/cm
Molar Volume: 100.6±3.0 cm3

Click to predict properties on the Chemicalize site


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