1,1-Dimethyl-5-methyleneheptyl valerate

Base Information

• Chemical Name: 1,1-Dimethyl-5-methyleneheptyl valerate
• CAS No.: 96846-65-0
• Molecular Formula: C15H28 O2
• Molecular Weight: 240.38162
• European Community (EC) Number: 306-301-6
• UNII: RV4A3425ES
• DSSTox Substance ID: DTXSID80242587
• Nikkaji Number: J333.669G
• Wikidata: Q83126374
• Mol file: 96846-65-0.mol

Synonyms:1,1-Dimethyl-5-methyleneheptyl valerate;96846-65-0;EINECS 306-301-6;RV4A3425ES;DTXSID80242587;AHRBCOJLJNGMPZ-UHFFFAOYSA-N;1,1-Dimethyl-5-methyleneheptyl pentanoate;NS00065485;Pentanoic acid, 1,1-dimethyl-5-methyleneheptyl ester

Chemical Property of 1,1-Dimethyl-5-methyleneheptyl valerate

Chemical Property:

• Vapor Pressure: 0.000828mmHg at 25°C
• Boiling Point: 305.3°Cat760mmHg
• Flash Point: 90°C
• PSA: 26.30000
• Density: 0.875g/cm³
• LogP: 4.63490
• XLogP3: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 240.208930132
• Heavy Atom Count: 17
• Complexity: 241

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(=O)OC(C)(C)CCCC(=C)CC