ChemSpider 2D Image | S-[2-Hydroxy(~2~H_4_)ethyl]-D-cysteine | C5H7D4NO3S

S-[2-Hydroxy(2H4)ethyl]-D-cysteine

  • Molecular FormulaC5H7D4NO3S
  • Average mass169.235 Da
  • Monoisotopic mass169.071075 Da
  • ChemSpider ID78076147

  • 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-(2-hydroxyethyl-1,1,2,2-d4)- [ACD/Index Name]
S-[2-Hydroxy(2H4)ethyl]-D-cystein [German] [ACD/IUPAC Name]
S-[2-Hydroxy(2H4)ethyl]-D-cysteine [ACD/IUPAC Name]
S-[2-Hydroxy(2H4)éthyl]-D-cystéine [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 379.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 72.6±6.0 kJ/mol
Flash Point: 183.6±27.9 °C
Index of Refraction: 1.571
Molar Refractivity: 39.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.42
ACD/LogD (pH 5.5): -2.87
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.90
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 15.8±0.5 10-24cm3
Surface Tension: 66.9±3.0 dyne/cm
Molar Volume: 121.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement