Benzoic acid, 2-hydroxy-6-(8,11-pentadecadienyl)-

Base Information

• Chemical Name: Benzoic acid, 2-hydroxy-6-(8,11-pentadecadienyl)-
• CAS No.: 18654-17-6
• Molecular Formula: C22H32O3
• DSSTox Substance ID: DTXSID501345046
• Nikkaji Number: J167.337H,J489.553C
• Wikidata: Q76414538
• Metabolomics Workbench ID: 136847
• ChEMBL ID: CHEMBL465536

Synonyms:(8E,11E)-Anacardic acid;Benzoic acid, 2-hydroxy-6-(8,11-pentadecadienyl)-;CHEMBL465536;18654-17-6;Salicylic acid, 6-(8,11-pentadecadienyl)-;Anacardic acid III;SCHEMBL4146215;SCHEMBL21705057;DTXSID501345046;BDBM50248617;2-Hydroxy-6-(8,11-pentadecadienyl)benzoic acid;6-[(8Z,11Z)-8,11-Pentadecadienyl]salicylic acid

Chemical Property of Benzoic acid, 2-hydroxy-6-(8,11-pentadecadienyl)-

Chemical Property:

• XLogP3: 7.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 13
• Exact Mass: 344.23514488
• Heavy Atom Count: 25
• Complexity: 400

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC=CCC=CCCCCCCCC1=C(C(=CC=C1)O)C(=O)O
• Isomeric SMILES: CCC/C=C/C/C=C/CCCCCCCC1=C(C(=CC=C1)O)C(=O)O

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