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About This Item
Empirical Formula (Hill Notation):
C5H3BrO2S
CAS Number:
Molecular Weight:
207.05
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
240-739-8
MDL number:
Assay:
97%
Form:
solid
InChI key
APBIZVFQQBCAAT-UHFFFAOYSA-N
InChI
1S/C5H3BrO2S/c6-4-2-9-1-3(4)5(7)8/h1-2H,(H,7,8)
SMILES string
OC(=O)c1cscc1Br
assay
97%
form
solid
mp
158-163 °C
functional group
bromo, carboxylic acid
Quality Level
Storage Class
11 - Combustible Solids
wgk
WGK 2
flash_point_f
Not applicable
flash_point_c
Not applicable
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Brandon C Fillmore et al.
ACS omega, 5(36), 22914-22925 (2020-09-22)
A pathway to a range of diverse heterocycles was developed using a nucleophilic cyclization strategy. Lactams and ene-imines are accessed in a few steps from a common precursor, and these moieties are further elaborated to directly provide pyrroles or pyridines
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