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Compound
2-Fluoro-4-(pyridin-2-ylmethoxy)benzoic acid
HCID
68577376
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Basic information
Standard SMILES
O=C(O)c1ccc(OCc2ccccn2)cc1F
InChIKey
WRTUKRCEVXORED-UHFFFAOYSA-N
Molecular formula
C13H10FNO3
Average molar mass
247.22 g/mol
Names & identifiers
Preferred name
2-Fluoro-4-(pyridin-2-ylmethoxy)benzoic acid
IUPAC
2-fluoro-4-(pyridin-2-ylmethoxy)benzoic acid
Names & synonyms
SCHEMBL4318791
DB-089930
869108-43-0
Database identifiers
PubChem CID
68577376
Properties
Computed structural properties
XLogP
2
Topological polar surface area
59.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
18
Formal charge
0
Complexity
287
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Related reactions
1 records
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HRID
199830
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Compound notes
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