ChemSpider 2D Image | S-(~2~H_3_)Methyl-D-cysteine | C4H6D3NO2S

S-(2H3)Methyl-D-cysteine

  • Molecular FormulaC4H6D3NO2S
  • Average mass138.203 Da
  • Monoisotopic mass138.054230 Da
  • ChemSpider ID78076127

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

D-Cysteine, S-methyl-d3- [ACD/Index Name]
S-(2H3)Methyl-D-cystein [German] [ACD/IUPAC Name]
S-(2H3)Methyl-D-cysteine [ACD/IUPAC Name]
S-(2H3)Méthyl-D-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: 300.3±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 59.4±6.0 kJ/mol
Flash Point: 135.4±26.5 °C
Index of Refraction: 1.540
Molar Refractivity: 33.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.38
ACD/LogD (pH 5.5): -2.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 89 Å2
Polarizability: 13.3±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 107.2±3.0 cm3

Click to predict properties on the Chemicalize site


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