ChemicalBook--->CAS DataBase List--->132794-07-1

132794-07-1

132794-07-1 Structure

132794-07-1 Structure
IdentificationMore
[Name]

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

132794-07-1
[Synonyms]

2,5-DIFLUORO-4-CHLOROBENZOIC ACID
4-CHLORO-2,5-DIFLUOROBENZOIC ACID
TIMTEC-BB SBB003617
2,5-Difluoro-4-chlorobenzoic
4-Chloro-2,5-difluorobenzoic acid 98%
4-Chloro-2,5-difluorobenzoicacid98%
[Molecular Formula]

C7H3ClF2O2
[MDL Number]

MFCD00077480
[Molecular Weight]

192.55
[MOL File]

132794-07-1.mol
Chemical PropertiesBack Directory
[Appearance]

OFF-WHITE CRYSTALLINE POWDER
[Melting point ]

154-157 °C (lit.)
[Boiling point ]

258°C (rough estimate)
[density ]

1.4821 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

Crystalline Powder
[pka]

2.70±0.10(Predicted)
[color ]

Off-white
[InChI]

InChI=1S/C7H3ClF2O2/c8-4-2-5(9)3(7(11)12)1-6(4)10/h1-2H,(H,11,12)
[InChIKey]

PEPCYJSDHYMIFN-UHFFFAOYSA-N
[SMILES]

C(O)(=O)C1=CC(F)=C(Cl)C=C1F
[CAS DataBase Reference]

132794-07-1(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302+H312+H332-H315-H319-H335
[Precautionary statements ]

P261-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29163990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

OFF-WHITE CRYSTALLINE POWDER
[Uses]

4-Chloro-2,5-difluorobenzoic acid reacts with substituted 2-hydroxy acetophenones in the presence of POCl3 to afford 2-acetylphenyl-4-chloro-2,5-difluorobenzoate.
[General Description]

4-Chloro-2,5-difluorobenzoic acid reacts with substituted 2-hydroxy acetophenones in the presence of POCl3 to afford 2-acetylphenyl-4-chloro-2,5-difluorobenzoate.
Questions And AnswerBack Directory
[Application]

4-Chloro-2,5-difluorobenzoic acid is a pharmaceutical intermediate that can be used to synthesize drugs that promote insulin secretion and inhibit the increase of blood glucose concentration. It can also be used to synthesize intermediates for protein kinase inhibitors and an isothiazole derivative, which is an intermediate for an anticancer drug.
Spectrum DetailBack Directory
[Spectrum Detail]

4-CHLORO-2,5-DIFLUOROBENZOIC ACID(132794-07-1)1HNMR
4-CHLORO-2,5-DIFLUOROBENZOIC ACID(132794-07-1)IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Chloro-2,5-difluorobenzoic acid, 97%(132794-07-1)
[Sigma Aldrich]

132794-07-1(sigmaaldrich)
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