4-(3'-Fluoro-biphenyl-4-yl)-4-oxo-butyric acid

HCID 23005236
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Basic information

Standard SMILES
O=C(O)CCC(=O)c1ccc(-c2cccc(F)c2)cc1
InChIKey
GTQFWMZFORJMOK-UHFFFAOYSA-N
Molecular formula
C16H13FO3
Average molar mass
272.27 g/mol

Names & identifiers

Preferred name
4-(3'-Fluoro-biphenyl-4-yl)-4-oxo-butyric acid
IUPAC
4-[4-(3-fluorophenyl)phenyl]-4-oxobutanoic acid

Names & synonyms

SCHEMBL7857494GTQFWMZFORJMOK-UHFFFAOYSA-NAKOS0041161354-(3'-fluoro-biphenyl-4-yl)-4-oxo-butyric acid

Database identifiers

PubChem CID
23005236

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
54.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
20

Related reactions

5 records
New reaction record

Compound notes

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