Phenyloctanoic acid

HCID 19348604
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Basic information

Standard SMILES
CCCCCCC(C(=O)O)c1ccccc1
InChIKey
CEUINTRVKVNPRT-UHFFFAOYSA-N
Molecular formula
C14H20O2
Average molar mass
220.31 g/mol
Monoisotopic mass
220.14632988

Names & identifiers

Preferred name
Phenyloctanoic acid
IUPAC
2-phenyloctanoic acid

Names & synonyms

phenyloctanoic acidHexylphenylessigsaureSCHEMBL1717107SCHEMBL10905511CEUINTRVKVNPRT-UHFFFAOYSA-NAKOS014768291

Database identifiers

PubChem CID
19348604
Nikkaji
J745.067B

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
7
Heavy atoms
16

Related reactions

1 records
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Compound notes

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