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About This Item
Linear Formula:
BrC6H2(Cl)(F)NH2
CAS Number:
Molecular Weight:
224.46
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
98%
InChI
1S/C6H4BrClFN/c7-4-1-3(8)2-5(9)6(4)10/h1-2H,10H2
SMILES string
Nc1c(F)cc(Cl)cc1Br
InChI key
HBHBARSMRVAINH-UHFFFAOYSA-N
assay
98%
mp
41-43 °C (lit.)
functional group
bromo, chloro, fluoro
General description
2-Bromo-4-chloro-6-fluoroaniline is an aniline derivative.
Application
2-Bromo-4-chloro-6-fluoroaniline may be used in the preparation of fragment A of an orally bioavailable and CNS penetrant bradykinin1antagonist.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
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
Regulatory Information
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Process development of a potent bradykinin 1 antagonist.
Menzel K, et al.
Organic Process Research & Development, 13(3), 519-524 (2009)
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