ChemSpider 2D Image | Dimethyl D-cystinate | C8H16N2O4S2

Dimethyl D-cystinate

  • Molecular FormulaC8H16N2O4S2
  • Average mass268.354 Da
  • Monoisotopic mass268.055145 Da
  • ChemSpider ID32800277

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

D-Cystinate de diméthyle [French] [ACD/IUPAC Name]
D-Cystine, dimethyl ester [ACD/Index Name]
Dimethyl D-cystinate [ACD/IUPAC Name]
Dimethyl-D-cystinat [German] [ACD/IUPAC Name]
298679-49-9 [RN]
444996-03-6 [RN]
D-Cystine dimethyl ester
Methyl (2S)-2-amino-3-{[(2S)-2-amino-3-methoxy-3-oxopropyl]disulfanyl}propanoate
Methyl (2S)-2-amino-3-{[(2S)-2-amino-3-methoxy-3-oxopropyl]disulphanyl}propanoate
MFCD27578191

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

Density: 1.3±0.1 g/cm3
Boiling Point: 375.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.3±3.0 kJ/mol
Flash Point: 180.9±27.9 °C
Index of Refraction: 1.558
Molar Refractivity: 65.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.61
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.91
ACD/LogD (pH 7.4): 0.58
ACD/BCF (pH 7.4): 1.60
ACD/KOC (pH 7.4): 47.83
Polar Surface Area: 155 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 54.8±3.0 dyne/cm
Molar Volume: 203.6±3.0 cm3

Click to predict properties on the Chemicalize site


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