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651027-00-8

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651027-00-8 Structure

651027-00-8 Structure
IdentificationBack Directory
[Name]

4-BroMo-3,5-difluorobenzoic acid
[CAS]

651027-00-8
[Synonyms]

4-BroMo-3,5-difluorobenzoic acid
Benzoic acid, 4-bromo-3,5-difluoro-
[Molecular Formula]

C7H3BrF2O2
[MDL Number]

MFCD18917156
[MOL File]

651027-00-8.mol
[Molecular Weight]

236.998
Chemical PropertiesBack Directory
[Melting point ]

181-185℃
[Boiling point ]

284.4±40.0 °C(Predicted)
[density ]

1.872±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[pka]

3.29±0.10(Predicted)
[InChI]

InChI=1S/C7H3BrF2O2/c8-6-4(9)1-3(7(11)12)2-5(6)10/h1-2H,(H,11,12)
[InChIKey]

NLLRAEQVOZOSBB-UHFFFAOYSA-N
[SMILES]

C(O)(=O)C1=CC(F)=C(Br)C(F)=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P280a-P304+P340-P305+P351+P338-P405-P501a
[HS Code ]

2916399090
Hazard InformationBack Directory
[Uses]

It is used as a pharmaceutical intermediate.
Spectrum DetailBack Directory
[Spectrum Detail]

4-BroMo-3,5-difluorobenzoic acid(651027-00-8)1HNMR
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