2-Fluorobenzoic acid, benzyl ester

HCID 579331
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Basic information

Standard SMILES
O=C(OCc1ccccc1)c1ccccc1F
InChIKey
BVLCXWRQHDRIIE-UHFFFAOYSA-N
Molecular formula
C14H11FO2
Average molar mass
230.23 g/mol
Monoisotopic mass
230.07430775

Names & identifiers

Preferred name
2-Fluorobenzoic acid, benzyl ester
IUPAC
benzyl 2-fluorobenzoate

Names & synonyms

Benzyl 2-fluorobenzoate2-Fluorobenzoic acid, benzyl esterBenzyl-2-fluorobenzoateBenzyl 2-fluorobenzoate #SCHEMBL521687MFCD04341248AKOS008908832H75868

Database identifiers

PubChem CID
579331
Nikkaji
J2.631.261B

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
17

Related reactions

5 records
New reaction record

Linked notes

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