4-Oxo-pentadecanoic acid

Base Information

• Chemical Name: 4-Oxo-pentadecanoic acid
• CAS No.: 109788-69-4
• Molecular Formula: C₁₅H₂₈O₃
• Molecular Weight: 256.386
• DSSTox Substance ID: DTXSID80911347
• Nikkaji Number: J206.161I
• Wikidata: Q82881456
• Metabolomics Workbench ID: 1570
• Mol file: 109788-69-4.mol

Synonyms:4-Oxopentadecanoic acid;4-oxo-pentadecanoic acid;4-keto pentadecanoic acid;109788-69-4;SCHEMBL8658408;DTXSID80911347;CHEBI:138494;LMFA01060047

Chemical Property of 4-Oxo-pentadecanoic acid

Chemical Property:

• PSA: 54.37000
• LogP: 4.34120
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 13
• Exact Mass: 256.20384475
• Heavy Atom Count: 18
• Complexity: 224

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCC(=O)CCC(=O)O