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249483

Sigma-Aldrich

2-(Trifluoromethyl)benzoyl chloride

99%

Synonym(s):

α,α,α-Trifluoro-o-toluoyl chloride

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About This Item

Linear Formula:
CF3C6H4COCl
CAS Number:
312-94-7
Molecular Weight:
208.56
Beilstein/REAXYS Number:
881040
EC Number:
206-233-6
MDL number:
MFCD00000667
UNSPSC Code:
12352100
PubChem Substance ID:
24854998
NACRES:
NA.22

assay

99%

form

liquid

refractive index

n20/D 1.479 (lit.)

bp

84-85 °C/16 mmHg (lit.)

density

1.416 g/mL at 25 °C (lit.)

SMILES string

FC(F)(F)c1ccccc1C(Cl)=O

InChI

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

InChI key

MXIUWSYTQJLIKE-UHFFFAOYSA-N

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Application

2-(Trifluoromethyl)benzoyl chloride may be used in chemical synthesis.

pictograms

Corrosion
GHS05

signalword

Danger

hcodes

H314

Hazard Classifications

Skin Corr. 1B

Storage Class

8A - Combustible corrosive hazardous materials

wgk_germany

WGK 3

flash_point_f

204.8 °F - closed cup

flash_point_c

96 °C - closed cup

ppe

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

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Certificates of Analysis (COA)

Lot/Batch Number
MKCC3941
MKBV7655V
MKBB9340V
95596PJ
MKBC6574

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D Premnath et al.
Interdisciplinary sciences, computational life sciences, 9(1), 130-139 (2016-01-05)
The commenced work deals with the synthesis, characterization and evaluation of biological activities of 4-amino-2,3-dimethyl-1-phenyl-3-pyrazolin-5-one. The synthesis was done by the condensation of aromatic acid chlorides with 4-aminoantipyrine. The structures of synthesized derivatives were elucidated using IR, Mass

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