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About This Item
Empirical Formula (Hill Notation):
C8H6BrN
CAS Number:
Molecular Weight:
196.04
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
233-208-7
Beilstein/REAXYS Number:
112877
MDL number:
Assay:
99%
Form:
powder
Quality Segment
assay
99%
form
powder
mp
90-92 °C (lit.)
SMILES string
Brc1ccc2[nH]ccc2c1
InChI
1S/C8H6BrN/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5,10H
InChI key
VXWVFZFZYXOBTA-UHFFFAOYSA-N
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
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Hui Peng et al.
Environmental science & technology, 50(1), 321-330 (2015-12-01)
Previously unreported natural and synthetic organo-bromine compounds (NSOBCs) have been found to contribute more than 99% of total organic bromine (TOB) in environmental matrices. We recently developed a novel untargeted method (data-independent precursor isolation and characteristic fragment, DIPIC-Frag) and identified
Lisa Cooper et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 24(23), 6105-6114 (2018-02-03)
Optimisation, scope and mechanism of the platinum-catalysed addition of indoles to indolylallenes is reported here to give 2,3'-BIMs with a novel core structure very relevant for pharmaceutical industry. The reaction is modulated by the electronic properties of the substituents on
Minna K Rahnasto et al.
Bioorganic & medicinal chemistry, 19(23), 7186-7193 (2011-10-25)
The human CYP2A6 enzyme metabolises several xenobiotics including nicotine, the addictive component in tobacco. Reduced activity of CYP2A6, either for genetic reasons or by administering inhibitors of CYP2A6, reduces tobacco smoking. The aim was to design novel inhibitors of CYP2A6