Pentanedioic acid, 2-mercaptoethyl methyl ester

Base Information

• Chemical Name: Pentanedioic acid, 2-mercaptoethyl methyl ester
• CAS No.: 70942-32-4
• Molecular Formula: C8H14 O4 S
• Molecular Weight: 206.25936
• European Community (EC) Number: 275-040-7
• UNII: XU9E3PX8FQ
• DSSTox Substance ID: DTXSID2072203
• Nikkaji Number: J288.697I
• Wikidata: Q82000146
• Mol file: 70942-32-4.mol

Synonyms:Pentanedioic acid, 2-mercaptoethyl methyl ester;2-Mercaptoethyl methyl glutarate;70942-32-4;XU9E3PX8FQ;EINECS 275-040-7;2'-Mercaptoethyl 4-carbomethoxybutanoate;Pentanedioic acid, 1-(2-mercaptoethyl) 5-methyl ester;UNII-XU9E3PX8FQ;DTXSID2072203;Pentanedioic acid 1-(2-mercaptoethyl)5-methyl ester

Chemical Property of Pentanedioic acid, 2-mercaptoethyl methyl ester

Chemical Property:

• Vapor Pressure: 0.00703mmHg at 25°C
• Boiling Point: 270°C at 760 mmHg
• Flash Point: 149.8°C
• PSA: 91.40000
• Density: 1.135g/cm³
• LogP: 0.80270
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 206.06128010
• Heavy Atom Count: 13
• Complexity: 170

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CCCC(=O)OCCS