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Key Documents

297836

Sigma-Aldrich

2-Chloro-4-fluorobenzoic acid

99%

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About This Item

Linear Formula:
ClC6H3(F)CO2H
CAS Number:
Molecular Weight:
174.56
Beilstein:
1946215
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

99%

form

solid

mp

181-183 °C (lit.)

solubility

95% ethanol: soluble 50 mg/mL, clear to very slightly hazy, colorless to very faintly yellow

functional group

carboxylic acid
chloro
fluoro

SMILES string

OC(=O)c1ccc(F)cc1Cl

InChI

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

InChI key

GRPWQLDSGNZEQE-UHFFFAOYSA-N

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Application

2-Chloro-4-fluorobenzoic acid was used in the preparation of 2-(2-chloro-4-fluorophenyl)-benzothiazole.

Pictograms

CorrosionExclamation mark

Signal Word

Danger

Hazard Statements

Hazard Classifications

Acute Tox. 4 Oral - Eye Dam. 1 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Synthesis and evaluation of novel benzothiazole derivatives against human cervical cancer cell lines.
Kini S, et al.
Indian Journal of Pharmaceutical Sciences, 69(1), 46-46 (2007)

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