ChemSpider 2D Image | MFCD12546019 | C3H4D3NO2S

MFCD12546019

  • Molecular FormulaC3H4D3NO2S
  • Average mass124.177 Da
  • Monoisotopic mass124.038582 Da
  • ChemSpider ID49073048

  • 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

L-(2,3,3-2H3)Cystein [German] [ACD/IUPAC Name]
L-(2,3,3-2H3)Cysteine [ACD/IUPAC Name]
L-(2,3,3-2H3)Cystéine [French] [ACD/IUPAC Name]
L-Cysteine-2,3,3-d3 [ACD/Index Name]
L-CYSTEINE-2,3,3-D3
MFCD12546019
214782-32-8 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 293.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 58.7±6.0 kJ/mol
Flash Point: 131.5±25.9 °C
Index of Refraction: 1.550
Molar Refractivity: 28.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.23
ACD/LogD (pH 5.5): -2.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 102 Å2
Polarizability: 11.5±0.5 10-24cm3
Surface Tension: 59.0±3.0 dyne/cm
Molar Volume: 90.8±3.0 cm3

Click to predict properties on the Chemicalize site


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