Decyl isovalerate

Base Information

• Chemical Name: Decyl isovalerate
• CAS No.: 72928-48-4
• Molecular Formula: C15H30O2
• Molecular Weight: 242.3975
• European Community (EC) Number: 277-077-4
• DSSTox Substance ID: DTXSID20868205
• Nikkaji Number: J296.413I
• Wikidata: Q63395423
• Mol file: 72928-48-4.mol

Synonyms:Decyl isovalerate;decyl 3-methylbutanoate;72928-48-4;Decyl iso-valerate;Butanoic acid, 3-methyl-, decyl ester;EINECS 277-077-4;Isovaleriansauredecylester;Isovaleric acid, decyl ester;SCHEMBL23948108;DTXSID20868205;3-Methylbutanoic acid decyl ester;Q63395423

Chemical Property of Decyl isovalerate

Chemical Property:

• Vapor Pressure: 0.00358mmHg at 25°C
• Boiling Point: 281.3°C at 760 mmHg
• Flash Point: 125°C
• PSA: 26.30000
• Density: 0.865g/cm³
• LogP: 4.71640
• XLogP3: 5.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 12
• Exact Mass: 242.224580195
• Heavy Atom Count: 17
• Complexity: 176

Purity/Quality:

98.5% ^*data from raw suppliers

DECYL-ISO-VALERATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCOC(=O)CC(C)C