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S-((2-Chloroethyl)carbamoyl)glutathione

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  • Name S-((2-Chloroethyl)carbamoyl)glutathione
  • EINECSN/A
  • CAS No. 38134-58-6
  • Density1.474g/cm3
  • PSA223.69000
  • LogP1.13100
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC13H21ClN4O7S
  • Boiling Point°Cat760mmHg
  • Molecular Weight412.89
  • Flash Point°C
  • Transport InformationN/A
  • AppearanceN/A
  • SafetyMutation data reported. When heated to decomposition it emits toxic vapors of NOx, SOx, and Cl.
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 38134-58-6 (S-((2-chloroethyl)carbamoyl)glutathione)
  • Hazard SymbolsN/A
  • SynonymsN/A

S-((2-Chloroethyl)carbamoyl)glutathione Chemical Properties

IUPAC Name: (2S)-2-Amino-5-[[(2R)-1-(carboxymethylamino)-3-(2-chloroethylcarbamoylsulfanyl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
Synonyms of S-((2-Chloroethyl)carbamoyl)glutathione (CAS NO.38134-58-6): 2-Chloroethyl-S-carbamoylglutathione ; Glycine, N-(S-(((2-chloroethyl)amino)carbonyl)-N-L-gamma-glutamyl-L-cysteinyl)-
InChI: InChI=1/C13H21ClN4O7S/c14-3-4-16-13(25)26-6-8(11(22)17-5-10(20)21)18-9(19)2-1-7(15)12(23)24/h7-8H,1-6,15H2,(H,16,25)(H,17,22)(H,18,19)(H,20,21)(H,23,24)/t7-,8-/m0/s1
CAS NO: 38134-58-6
Molecular Formula: C13H21ClN4O7S
Molecular Weight : 412.8464
Molecular Structure:
H bond acceptors: 11
H bond donors: 7
Freely Rotating Bonds: 14
Polar Surface Area: 142.07 Å2
Index of Refraction: 1.575
Molar Refractivity: 92.57 cm3
Molar Volume: 279.9 cm3
Surface Tension: 68.3 dyne/cm
Density: 1.474 g/cm3

S-((2-Chloroethyl)carbamoyl)glutathione Toxicity Data With Reference

1.    

dnd-hmn-lym 100 nmol/L

    CRTOEC    Chemical Research in Toxicology. 5 (1992),106.

S-((2-Chloroethyl)carbamoyl)glutathione Safety Profile

Mutation data reported. When S-((2-Chloroethyl)carbamoyl)glutathione (CAS NO.38134-58-6) is heated to decomposition ,it emits toxic vapors of NOx, SOx, and Cl.

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