ChemSpider 2D Image | S-{[3-(Methylsulfinyl)propyl]carbamothioyl}cysteine | C8H16N2O3S3

S-{[3-(Methylsulfinyl)propyl]carbamothioyl}cysteine

  • Molecular FormulaC8H16N2O3S3
  • Average mass284.419 Da
  • Monoisotopic mass284.032288 Da
  • ChemSpider ID28557609

More details:

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

Cysteine, S-[[[3-(methylsulfinyl)propyl]amino]thioxomethyl]- [ACD/Index Name]
S-{[3-(Methylsulfinyl)propyl]carbamothioyl}cystein [German] [ACD/IUPAC Name]
S-{[3-(Methylsulfinyl)propyl]carbamothioyl}cysteine [ACD/IUPAC Name]
S-{[3-(Méthylsulfinyl)propyl]carbamothioyl}cystéine [French] [ACD/IUPAC Name]
2-AMINO-3-{[(3-METHANESULFINYLPROPYL)CARBAMOTHIOYL]SULFANYL}PROPANOIC ACID
919990-31-1 [RN]
L-CYSTEINE, S-[[[3-(METHYLSULFINYL)PROPYL]AMINO]THIOXOMETHYL]- [ACD/Index 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: 539.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 89.4±6.0 kJ/mol
Flash Point: 280.1±32.9 °C
Index of Refraction: 1.653
Molar Refractivity: 71.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: -0.23
ACD/LogD (pH 5.5): -2.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 169 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 83.8±3.0 dyne/cm
Molar Volume: 196.5±3.0 cm3

Click to predict properties on the Chemicalize site


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