ChemicalBook--->CAS DataBase List--->446-30-0

446-30-0

446-30-0 Structure

446-30-0 Structure
IdentificationMore
[Name]

4-Chloro-2-fluorobenzoic acid
[CAS]

446-30-0
[Synonyms]

2-FLUORO-4-CHLOROBENZOIC ACID
4-CHLORO-2-FLUOROBENZOIC ACID
BUTTPARK 19\01-70
RARECHEM AL BO 0755
TIMTEC-BB SBB003797
Benzoic acid, 4-chloro-2-fluoro-
4-Chloro-2-Fluorobenzoic Acid 2-Fluoro-4-Chlorobenzoic Acid
4-CHLORO-2-FLUOROBENZOIC ACID 98%(HPL&
4-Chloro-2-Fluorobenzoic
4-Chloro-2-fluorobenzoic acid 98%
4-Chloro-2-fluorobenzoicacid98%
[EINECS(EC#)]

207-162-3
[Molecular Formula]

C7H4ClFO2
[MDL Number]

MFCD00042468
[Molecular Weight]

174.56
[MOL File]

446-30-0.mol
Chemical PropertiesBack Directory
[Appearance]

White to light yellow crystal powder
[Melting point ]

204-208 °C (lit.)
[Boiling point ]

274.7±20.0 °C(Predicted)
[density ]

1.4016 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

powder to crystal
[pka]

3.04±0.10(Predicted)
[color ]

White to Almost white
[Water Solubility ]

insoluble
[BRN ]

973358
[InChI]

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

ZLPXBWMVZANJJQ-UHFFFAOYSA-N
[SMILES]

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

446-30-0(CAS DataBase Reference)
[NIST Chemistry Reference]

4-Chloro-2-fluorobenzoic acid(446-30-0)
[EPA Substance Registry System]

Benzoic acid, 4-chloro-2-fluoro- (446-30-0)
Safety DataBack Directory
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R22:Harmful if swallowed.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[TSCA ]

TSCA listed
[HazardClass ]

IRRITANT
[HS Code ]

29163990
Hazard InformationBack Directory
[Chemical Properties]

White to light yellow crystal powder
[Uses]

4-Chloro-2-fluorobenzoic acid may be used in the following studies:
  • As starting reagent for the synthesis of furosemide.
  • Synthesis of 4′-chloro-2′-fluoroacetophenone.
  • Synthesis of novel herbicidal isoxazolecarboxamides.
  • Preparation of potential liquid crystals.
[General Description]

4-Chloro-2-fluorobenzoic acid is a halogen benzoic acid. It is a non-liquid crystalline carboxylic acid derivative. It has been reported to form hydrogen bonded complexes with benzoylhydrazine-based azobenzene compound. Octanol/water partition coefficient Kow of 4-chloro-2-fluorobenzoic acid has been determined by shake-flask method.
Spectrum DetailBack Directory
[Spectrum Detail]

4-Chloro-2-fluorobenzoic acid(446-30-0)MS
4-Chloro-2-fluorobenzoic acid(446-30-0)1HNMR
4-Chloro-2-fluorobenzoic acid(446-30-0)IR1
4-Chloro-2-fluorobenzoic acid(446-30-0)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Chloro-2-fluorobenzoic acid, 98%(446-30-0)
[Alfa Aesar]

4-Chloro-2-fluorobenzoic acid, 98%(446-30-0)
[Sigma Aldrich]

446-30-0(sigmaaldrich)
[TCI AMERICA]

4-Chloro-2-fluorobenzoic Acid,>98.0%(T)(446-30-0)
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