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About This Item
Empirical Formula (Hill Notation):
C8H6ClNOS
CAS Number:
Molecular Weight:
199.66
UNSPSC Code:
12352100
PubChem Substance ID:
MDL number:
InChI
1S/C8H6ClNOS/c9-5-1-2-6-7(3-5)12-4-8(11)10-6/h1-3H,4H2,(H,10,11)
SMILES string
Clc1ccc2NC(=O)CSc2c1
InChI key
JNPOLSNJHCFNCG-UHFFFAOYSA-N
assay
97%
mp
212-216 °C (lit.)
Application
7-Chloro-2H-1,4-benzothiazin-3(4H)-one may be used as a starting material to synthesize 2H-1,4-benzothiazine-3(4H)-thione.
Storage Class
13 - Non Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
Regulatory Information
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Synthesis, benzodiazepine receptor binding, and anticonvulsant activity of 2, 3-dihydro-3-oxo-5H-pyrido [3, 4-b][1,4] benzothiazine-4-carbonitriles.
Chorvat RJ, et al.
Journal of Medicinal Chemistry, 26(6), 845-850 (1983)
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