ChemicalBook--->CAS DataBase List--->161957-55-7

161957-55-7

161957-55-7 Structure

161957-55-7 Structure
IdentificationMore
[Name]

3-Chloro-2-fluorobenzoic acid
[CAS]

161957-55-7
[Synonyms]

2-FLUORO-3-CHLOROBENZOIC ACID
3-CHLORO-2-FLUOROBENZOIC ACID
BUTTPARK 14\01-29
RARECHEM AL BO 1303
3-Chloro-2-Fluorobenzoic Acid 2-Fluoro-3-Chlorobenzoic Acid
3-Chloro-2-Fluorobenzoic
3-Chloro-2-fluorobenzoic acid 98%
3-Chloro-2-fluorobenzoicacid98%
[EINECS(EC#)]

630-303-9
[Molecular Formula]

C7H4ClFO2
[MDL Number]

MFCD00042506
[Molecular Weight]

174.56
[MOL File]

161957-55-7.mol
Chemical PropertiesBack Directory
[Appearance]

white to light yellow crystal powder
[Melting point ]

177-180 °C (lit.)
[Boiling point ]

278.9±20.0 °C(Predicted)
[density ]

1.477±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

soluble in Methanol
[form ]

powder to crystal
[pka]

2.90±0.10(Predicted)
[color ]

White to Light yellow to Light red
[BRN ]

7127637
[InChI]

InChI=1S/C7H4ClFO2/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,(H,10,11)
[InChIKey]

FCSSYEWURMTUSM-UHFFFAOYSA-N
[SMILES]

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

161957-55-7(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi,Xn
[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 ]

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29163990
Hazard InformationBack Directory
[Chemical Properties]

white to light yellow crystal powder
[Synthesis Reference(s)]

Tetrahedron Letters, 36, p. 881, 1995 DOI: 10.1016/0040-4039(94)02385-O
Spectrum DetailBack Directory
[Spectrum Detail]

3-Chloro-2-fluorobenzoic acid(161957-55-7)IR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

3-Chloro-2-fluorobenzoic acid, 97%(161957-55-7)
[Sigma Aldrich]

161957-55-7(sigmaaldrich)
[TCI AMERICA]

3-Chloro-2-fluorobenzoic Acid,>97.0%(GC)(T)(161957-55-7)
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