Methyl 6-cyanohexanoate

Base Information

• Chemical Name: Methyl 6-cyanohexanoate
• CAS No.: 17592-25-5
• Molecular Formula: C8H13NO2
• Molecular Weight: 155.197
• DSSTox Substance ID: DTXSID60496920
• Wikidata: Q82346107
• Mol file: 17592-25-5.mol

Synonyms:methyl 6-cyanohexanoate;17592-25-5;Hexanoic acid, 6-cyano-, methyl ester;SCHEMBL5977199;DTXSID60496920

Chemical Property of Methyl 6-cyanohexanoate

Chemical Property:

• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 155.094628657
• Heavy Atom Count: 11
• Complexity: 157

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CCCCCC#N