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297712

4-Bromo-3-(trifluoromethyl)aniline

98%

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About This Item

Linear Formula:
BrC6H3(CF3)NH2
CAS Number:
393-36-2
Molecular Weight:
240.02
NACRES:
NA.22
PubChem Substance ID:
24857923
UNSPSC Code:
12352100
EC Number:
206-885-1
MDL number:
MFCD00007827
Assay:
98%
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assay

98%

bp

81-84 °C/0.5 mmHg (lit.)

mp

47-49 °C (lit.)

functional group

bromo, fluoro

SMILES string

Nc1ccc(Br)c(c1)C(F)(F)F

InChI

1S/C7H5BrF3N/c8-6-2-1-4(12)3-5(6)7(9,10)11/h1-3H,12H2

InChI key

YGNISOAUPSJDJE-UHFFFAOYSA-N

Application

4-Bromo-3-(trifluoromethyl)aniline has been used in the preparation of:
  • 2,5-dibromo-(trifluoromethyl)benzene and 2-bromo-5-iodo-(trifluoromethyl)benzene
  • AUY954, an aminocarboxylate analog of FTY720, a low nanomolar, monoselective agonist of the sphingosine-1-phosphate receptor

signalword

Danger

Hazard Classifications

Acute Tox. 3 Oral - Aquatic Chronic 2 - Eye Irrit. 2 - Skin Irrit. 2 - Skin Sens. 1B - STOT RE 2 Oral

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 3

flash_point_f

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Gloves

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