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2-(3-Fluoro-6-methoxybenzoyl)benzoic acid

HCID 178766469
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Basic information

CAS
135030-71-6
Standard SMILES
COc1ccc(F)cc1C(=O)c1ccccc1C(=O)O
InChIKey
YNXYXVNBWMAMIV-UHFFFAOYSA-N
Molecular formula
C15H11FO4
Average molar mass
274.24 g/mol

Names & identifiers

Preferred name
2-(3-Fluoro-6-methoxybenzoyl)benzoic acid
IUPAC
2-(5-fluoro-2-methoxybenzoyl)benzoic acid
English name
2-(3-Fluoro-6-methoxybenzoyl)benzoic acid
Molecular formula
C15H11FO4
Molecular weight
274.24

Names & synonyms

135030-71-62-(3-Fluoro-6-methoxybenzoyl)benzoic acid2-(5-fluoro-2-methoxybenzoyl)benzoic acidMFCD077760272-(5-fluoro-2-methoxybenzoyl)benzoicacid2-(5-fluoro-2-methoxy-benzoyl)benzoic acidF398540Benzoic acid, 2-(5-fluoro-2-methoxybenzoyl)-

Database identifiers

CAS
135030-71-6

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
63.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
20
Formal charge
0
Complexity
371

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