ChemSpider 2D Image | S-(Carboxymethyl)(2,3,3-~2~H_3_)cysteine | C5H6D3NO4S

S-(Carboxymethyl)(2,3,3-2H3)cysteine

  • Molecular FormulaC5H6D3NO4S
  • Average mass182.213 Da
  • Monoisotopic mass182.044052 Da
  • ChemSpider ID58781844

  • Non-standard isotope - Non-standard isotope

More details:

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

Cysteine-2,3,3-d3, S-(carboxymethyl)- [ACD/Index Name]
S-(Carboxymethyl)(2,3,3-2H3)cystein [German] [ACD/IUPAC Name]
S-(Carboxymethyl)(2,3,3-2H3)cysteine [ACD/IUPAC Name]
S-(Carboxyméthyl)(2,3,3-2H3)cystéine [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 417.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 73.6±6.0 kJ/mol
Flash Point: 206.2±28.7 °C
Index of Refraction: 1.588
Molar Refractivity: 39.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.32
ACD/LogD (pH 5.5): -3.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 126 Å2
Polarizability: 15.8±0.5 10-24cm3
Surface Tension: 78.0±3.0 dyne/cm
Molar Volume: 118.3±3.0 cm3

Click to predict properties on the Chemicalize site


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