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About This Item
Empirical Formula (Hill Notation):
C5H4BrNOS
CAS Number:
Molecular Weight:
206.06
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Product Name
4-Bromothiophene-3-carboxamide, 97%
InChI
1S/C5H4BrNOS/c6-4-2-9-1-3(4)5(7)8/h1-2H,(H2,7,8)
SMILES string
NC(=O)c1cscc1Br
InChI key
BMZBDWPOBVGKSU-UHFFFAOYSA-N
assay
97%
form
solid
mp
150-155 °C
signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
Regulatory Information
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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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