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3-[(4-Fluorophenyl)methyl]benzoic acid

HCID 46882001
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
886569-97-7
Standard SMILES
O=C(O)c1cccc(Cc2ccc(F)cc2)c1
InChIKey
IQZZTFXFBHYWOL-UHFFFAOYSA-N
Molecular formula
C14H11FO2
Average molar mass
230.238 g/mol
Monoisotopic mass
230.07430781

Names & identifiers

Preferred name
3-[(4-Fluorophenyl)methyl]benzoic acid
IUPAC
3-[(4-Fluorophenyl)methyl]benzoic acid
English name
3-(4-Fluoro-Benzyl)-Benzoic Acid
Molecular formula
C14H11FO2
Molecular weight
230.23

Names & synonyms

3-(4-Fluoro-Benzyl)-Benzoic Acid3-[(4-Fluorophenyl)methyl]benzoic acidBenzoic acid, 3-[(4-fluorophenyl)methyl]-3-(4-Fluoro-Benzyl)-Benzoic Acid(WX612088)

Database identifiers

CAS
886569-97-7
PubChem CID
46882001
DTXSID
DTXSID301285157
ChEMBL
CHEMBL1079011
Nikkaji
J2.699.539F

Properties

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

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Compound notes

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