Benzenepentanoic acid, phenyl ester

Base Information

• Chemical Name: Benzenepentanoic acid, phenyl ester
• CAS No.: 189251-08-9
• Molecular Formula: C17H18O2
• DSSTox Substance ID: DTXSID20449331
• Nikkaji Number: J824.921K
• Wikidata: Q82268755
• Mol file: 189251-08-9.mol

Synonyms:Benzenepentanoic acid, phenyl ester;189251-08-9;SCHEMBL9078593;Benzenevaleric acid phenyl ester;DTXSID20449331;QGHHZJILQNWGDF-UHFFFAOYSA-N;5-Phenylvaleric acid, phenyl ester

Chemical Property of Benzenepentanoic acid, phenyl ester

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 254.130679813
• Heavy Atom Count: 19
• Complexity: 250

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CCCCC(=O)OC2=CC=CC=C2