Vitas-M small molecule compound

5-bromo-2-oxo-1,3-benzoxathiol-6-yl 2-chloroethyl carbonate

Catalog ID
STK763998
SMILES ClCCOC(=O)Oc1cc2oc(=O)sc2cc1Br

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C10H6BrClO5S MW 353.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H6BrClO5S/c11-5-3-8-7(17-10(14)18-8)4-6(5)16-9(13)15-2-1-12/h3-4H,1-2H2
InChIKey
DOQAFYDHHIOMNW-UHFFFAOYSA-N
Synonyms
361468-68-0
(5BROMO2OXO13BENZOXATHIOL6YL)2CHLOROETHYLCARBONATE
361468680
5bromo2oxo13benzoxathiol6yl2chloroethylcarbonate
5bromo2oxobenzo(d)(13)oxathiol6yl(2chloroethyl)carbonate
C1=C2C(=CC(=C1OC(=O)OCCCl)Br)SC(=O)O2
CARBONICACID(5BROMO2OXO13BENZOXATHIOL6YL)2CHLOROETHYLESTER
InChI=1SC10H6BrClO5Sc115387(1710(14)188)46(5)169(13)152112h34H12H2
MFCD02648116
ZINC000001800130
ZINC01800130
ZINC1800130

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.