S-(2-Chloroethyl)cysteinyl-N-gamma-glutamylglycine

Base Information

• Chemical Name: S-(2-Chloroethyl)cysteinyl-N-gamma-glutamylglycine
• CAS No.: 75607-61-3
• Molecular Formula: C₁₂H₂₀ClN₃O₆S
• Molecular Weight: 369.826
• DSSTox Substance ID: DTXSID70997054
• Mol file: 75607-61-3.mol

Synonyms:DTXSID70997054;LS-72397;S-(2-Chloroethyl)cysteinyl-N-gamma-glutamylglycine

Chemical Property of S-(2-Chloroethyl)cysteinyl-N-gamma-glutamylglycine

Chemical Property:

• Vapor Pressure: 6.22E-19mmHg at 25°C
• Boiling Point: 656.5°C at 760 mmHg
• Flash Point: 350.9°C
• PSA: 189.32000
• Density: 1.474g/cm³
• LogP: 0.31820
• XLogP3: -6.1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 11
• Exact Mass: 369.0761342
• Heavy Atom Count: 23
• Complexity: 451

Purity/Quality:

99% ^*data from raw suppliers

S-(2-CHLOROETHYL)GLUTATHIONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CC(=O)N(CC(=O)O)C(=O)C(CSCCCl)N)C(C(=O)O)N
• Isomeric SMILES: C(CC(=O)N(CC(=O)O)C(=O)[C@H](CSCCCl)N)[C@@H](C(=O)O)N

Technology Process of S-(2-Chloroethyl)cysteinyl-N-gamma-glutamylglycine

There total 1 articles about S-(2-Chloroethyl)cysteinyl-N-gamma-glutamylglycine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

1-Bromo-2-chloroethane (107-04-0) + glutathione trisodium → S-(2-chloroethyl)glutathione (75607-61-3)

Guidance literature:

In methanol;

DOI:10.1021/tx0100183

Reference yield:

H-Cys-Tyr-Ile-Gln-Asn-Cys-Pro-Leu-Gly-NH2 (17912-60-6) + S-(2-chloroethyl)glutathione (75607-61-3) → C55H87N15O18S3 + C55H87N15O18S3 + C67H106N18O24S4

Guidance literature:

With ammonium bicarbonate; In water; at 25 ℃; for 1.5h; pH=7.0 - 7.4;

DOI:10.1021/tx00045a013

upstream raw materials:

1-Bromo-2-chloroethane