S-Benzyl-L-cysteine benzyl ester hydrochloride

Base Information

• Chemical Name: S-Benzyl-L-cysteine benzyl ester hydrochloride
• CAS No.: 4561-11-9
• Molecular Formula: C17H19 N O2 S . Cl H
• Molecular Weight: 337.87
• Hs Code.: 2930909090
• DSSTox Substance ID: DTXSID30693146
• Mol file: 4561-11-9.mol

Synonyms:4561-11-9;S-Benzyl-L-cysteine benzyl ester hydrochloride;Benzyl S-benzyl-L-cysteinate hydrochloride;H-Cys(Bzl)-OBzl.HCl;H-Cys(Bzl)-OBzl-HCl;H-CYS(BZL)-OBZLHCL;DTXSID30693146;AKOS015950981;AM81689;S-benzylcysteine benzyl ester hydrochloride;Benzyl S-benzyl-L-cysteinate--hydrogen chloride (1/1);(R)-benzyl 2-amino-3-(benzylthio)propanoate hydrochloride;benzyl (2R)-2-amino-3-benzylsulfanylpropanoate;hydrochloride

Chemical Property of S-Benzyl-L-cysteine benzyl ester hydrochloride

Chemical Property:

• Melting Point: 148-151 °C
• PSA: 77.62000
• LogP: 4.49280
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 337.0903277
• Heavy Atom Count: 22
• Complexity: 299

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC(=O)C(CSCC2=CC=CC=C2)N.Cl
• Isomeric SMILES: C1=CC=C(C=C1)COC(=O)[C@H](CSCC2=CC=CC=C2)N.Cl