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
存储类别
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