Furfuryl 3-mercapto-2-methylpropionate

Base Information

• Chemical Name: Furfuryl 3-mercapto-2-methylpropionate
• CAS No.: 93859-18-8
• Molecular Formula: C9H12 O3 S
• Molecular Weight: 200.25478
• European Community (EC) Number: 299-354-9
• DSSTox Substance ID: DTXSID50917391
• Nikkaji Number: J318.445E
• Mol file: 93859-18-8.mol

Synonyms:93859-18-8;Furfuryl 3-mercapto-2-methylpropionate;EINECS 299-354-9;Furan-2-ylmethyl 3-mercapto-2-methylpropanoate;DTXSID50917391;(Furan-2-yl)methyl 2-methyl-3-sulfanylpropanoate;3-Mercapto-2-methylpropanoic acid 2-furanylmethyl ester

Chemical Property of Furfuryl 3-mercapto-2-methylpropionate

Chemical Property:

• Vapor Pressure: 0.00388mmHg at 25°C
• Boiling Point: 280°Cat760mmHg
• Flash Point: 123.1°C
• PSA: 78.24000
• Density: 1.161g/cm³
• LogP: 1.88870
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 200.05071541
• Heavy Atom Count: 13
• Complexity: 172

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CS)C(=O)OCC1=CC=CO1