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Vitas-M small molecule compound

2-(1,3-benzothiazol-2-yl)-4-nitrophenol

Catalog ID
STL505913
SMILES Oc1ccc(cc1c1nc2c(s1)cccc2)[N+](=O)[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 C13H8N2O3S MW 272.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H8N2O3S/c16-11-6-5-8(15(17)18)7-9(11)13-14-10-3-1-2-4-12(10)19-13/h1-7,16H
InChIKey
NJTASTNGXOTNOF-UHFFFAOYSA-N
Synonyms
6276-77-3
(6E)6(3H13BENZOTHIAZOL2YLIDENE)4NITROCYCLOHEXA24DIEN1ONE
(6Z)6(3H13BENZOTHIAZOL2YLIDENE)4NITROCYCLOHEXA24DIEN1ONE
2(13benzothiazol2yl)4nitrophenol
2(2BENZO(D)THIAZOLYL)4NITROPHENOL
2(BENZOTHIAZOLE2YL)4NITROPHENOL
234665
6(3H13BENZOTHIAZOL2YLIDENE)4NITROCYCLOHEXA24DIEN1ONE
6276773
InChI=1SC13H8N2O3Sc1611658(15(17)18)79(11)131410312412(10)1913h1716H
MFCD01707777
ZINC000004777807

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Available files

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

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