Vitas-M small molecule compound

5-bromo-6-hydroxy-1,3-benzoxathiol-2-one

Catalog ID
STK677273
SMILES O=c1sc2c(o1)cc(c(c2)Br)O

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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 C7H3BrO3S MW 247.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H3BrO3S/c8-3-1-6-5(2-4(3)9)11-7(10)12-6/h1-2,9H
InChIKey
SCQGQMLODYVREA-UHFFFAOYSA-N
Synonyms
381681-61-4
13BENZOXATHIOL2ONE5BROMO6HYDROXY
381681614
5bromo6hydroxy13benzoxathiol2one
5BROMO6HYDROXYBENZO(D)13OXATHIOLEN2ONE
C1=C2C(=CC(=C1O)Br)SC(=O)O2
InChI=1SC7H3BrO3Sc83165(24(3)9)117(10)126h129H
MFCD02933083
ZINC000000032648
ZINC00032648
ZINC32648

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Available files

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