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Merck
CN

250279

3-(Trifluoromethyl)benzoyl chloride

98%

Synonym(s):

α,α,α-Trifluoro-m-toluoyl chloride

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About This Item

Linear Formula:
CF3C6H4COCl
CAS Number:
Molecular Weight:
208.56
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
218-844-5
Beilstein/REAXYS Number:
391266
MDL number:
Assay:
98%
Form:
liquid
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Quality Segment

assay

98%

form

liquid

refractive index

n20/D 1.477 (lit.)

bp

184-186 °C/750 mmHg (lit.)

density

1.383 g/mL at 25 °C (lit.)

functional group

acyl chloride, fluoro

SMILES string

FC(F)(F)c1cccc(c1)C(Cl)=O

InChI

1S/C8H4ClF3O/c9-7(13)5-2-1-3-6(4-5)8(10,11)12/h1-4H

InChI key

RUJYJCANMOTJMO-UHFFFAOYSA-N

Application

3-(Trifluoromethyl)benzoyl chloride has been used in the preparation of intermediates, required for synthesis of C-2 and C-3 substituted pyrazolo[1,5-a]pyrimidines.


pictograms

Corrosion

signalword

Danger

hcodes

Hazard Classifications

Skin Corr. 1B

Storage Class

8A - Combustible corrosive hazardous materials

wgk

WGK 3

flash_point_f

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

ppe

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter



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