Vitas-M small molecule compound

methyl 5-chloro-2-hydroxy-3-nitrobenzoate

Catalog ID
STK392165
SMILES COC(=O)c1cc(Cl)cc(c1O)[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 C8H6ClNO5 MW 231.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H6ClNO5/c1-15-8(12)5-2-4(9)3-6(7(5)11)10(13)14/h2-3,11H,1H3
InChIKey
FIUDEVZDUKTMAC-UHFFFAOYSA-N
Synonyms
5043-79-8
5043798
5CHLORO2HYDROXY3NITROBENZOICACIDMETHYLESTER
BENZOICACID5CHLORO2HYDROXY3NITROMETHYLESTER
COC(=O)C1=CC(=CC(=C1O)(N+)(=O)(O))Cl
COC(=O)c1cc(Cl)cc(c1O)(N+)(=O)(O)
InChI=1SC8H6ClNO5c1158(12)524(9)36(7(5)11)10(13)14h2311H1H3
methyl5chloro2hydroxy3nitrobenzoate
METHYL5CHLORO3NITROSALICYLATE
MFCD00458678
ZINC000004014514
ZINC4014514

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Available files

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