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64695-84-7

64695-84-7 Structure

64695-84-7 Structure
IdentificationMore
[Name]

2-BROMO-4,5-DIFLUOROBENZOIC ACID
[CAS]

64695-84-7
[Synonyms]

2-BROMO-4,5-DIFLUOROBENZOIC ACID
[Molecular Formula]

C7H3BrF2O2
[MDL Number]

MFCD04973422
[Molecular Weight]

237
[MOL File]

64695-84-7.mol
Chemical PropertiesBack Directory
[Appearance]

White to yellow crystalline powder
[Melting point ]

118-122 °C (lit.)
[Boiling point ]

291.3±40.0 °C(Predicted)
[density ]

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

Keep in dark place,Sealed in dry,Room Temperature
[solubility ]

soluble in Methanol
[form ]

Crystalline Powder
[pka]

2.45±0.10(Predicted)
[color ]

White to yellow
[InChI]

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

DGCBGBZYTNTZJH-UHFFFAOYSA-N
[SMILES]

C(O)(=O)C1=CC(F)=C(F)C=C1Br
[CAS DataBase Reference]

64695-84-7(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R22:Harmful if swallowed.
[Safety Statements ]

S36:Wear suitable protective clothing .
[RIDADR ]

UN 2811 6.1/PG 3
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29163990
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Hazard InformationBack Directory
[Chemical Properties]

White to yellow crystalline powder
[Uses]

2-Bromo-4,5-difluorobenzoic acid is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
[Synthesis]

The synthesis of 2-bromo-4, 5-difluorobenzoic acid was achieved from difluorophthalic anhydride by either using a Losen rearrangement or the Barton bromodecarboxylation reaction.
Spectrum DetailBack Directory
[Spectrum Detail]

2-BROMO-4,5-DIFLUOROBENZOIC ACID(64695-84-7)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

64695-84-7(sigmaaldrich)
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