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518700

Sigma-Aldrich

2-Bromo-4-(trifluoromethyl)aniline

97%

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About This Item

Linear Formula:
BrC6H3(CF3)NH2
CAS Number:
57946-63-1
Molecular Weight:
240.02
EC Number:
261-035-7
MDL number:
MFCD00042150
UNSPSC Code:
12352100
PubChem Substance ID:
24874039
NACRES:
NA.22

assay

97%

refractive index

n20/D 1.524 (lit.)

bp

109-110 °C/10 mmHg (lit.)

SMILES string

Nc1ccc(cc1Br)C(F)(F)F

InChI

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

InChI key

QKRJIXSZTKOFTD-UHFFFAOYSA-N

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk_germany

WGK 3

flash_point_f

230.0 °F - closed cup

flash_point_c

110 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

Certificates of Analysis (COA)

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G B Scarfe et al.
Xenobiotica; the fate of foreign compounds in biological systems, 28(4), 373-388 (1998-05-30)
1. The metabolic fate and urinary excretion of 2-bromo-4-trifluoromethylaniline has been studied in rat using 19F-NMR spectroscopic and directly coupled HPLC-NMR-MS methods. The compound was dosed to Sprague-Dawley rats (50 mg kg-1, i.p.) and urine collected over 0-8, 8-24 and

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