Octyl 4-benzoylbenzoate

Base Information

• Chemical Name: Octyl 4-benzoylbenzoate
• CAS No.: 62086-78-6
• Molecular Formula: C22H26O3
• DSSTox Substance ID: DTXSID20606068
• Wikidata: Q82504622
• Mol file: 62086-78-6.mol

Synonyms:OCTYL 4-BENZOYLBENZOATE;62086-78-6;Benzoic acid, 4-benzoyl-, octyl ester;SCHEMBL11652541;DTXSID20606068

Chemical Property of Octyl 4-benzoylbenzoate

Chemical Property:

• XLogP3: 7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 11
• Exact Mass: 338.18819469
• Heavy Atom Count: 25
• Complexity: 390

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2