4-(5-Chloro-2-fluorobenzyl)nicotinic acid

HCID 19974760
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Basic information

Standard SMILES
O=C(O)c1cnccc1Cc1cc(Cl)ccc1F
InChIKey
RDFIXFCSJQEZMC-UHFFFAOYSA-N
Molecular formula
C13H9ClFNO2
Average molar mass
265.67 g/mol

Names & identifiers

Preferred name
4-(5-Chloro-2-fluorobenzyl)nicotinic acid
IUPAC
4-[(5-chloro-2-fluorophenyl)methyl]pyridine-3-carboxylic acid

Names & synonyms

SCHEMBL7814349RDFIXFCSJQEZMC-UHFFFAOYSA-N4-(5-chloro-2-fluorobenzyl)nicotinic acid

Database identifiers

PubChem CID
19974760

Properties

Computed structural properties

XLogP
3
Topological polar surface area
50.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
18

Related reactions

7 records
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Compound notes

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