Vitas-M small molecule compound
2-(acetyloxy)-5-nitrobenzoic acid
Catalog ID
STK386183
SMILES CC(=O)Oc1ccc(cc1C(=O)O)[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 C9H7NO6 MW 225.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H7NO6/c1-5(11)16-8-3-2-6(10(14)15)4-7(8)9(12)13/h2-4H,1H3,(H,12,13)InChIKey
GLNHSJMDXOHYPL-UHFFFAOYSA-NSynonyms
17336-14-017336140
2(ACETYLOXY)5NITROBENZOICACID
2ACETOXY5NITROBENZOATE
2ACETOXY5NITROBENZOICACID
2ACETYLOXY5NITROBENZOICACID
CC(=O)OC1=C(C=C(C=C1)(N+)(=O)(O))C(=O)O
CC(=O)Oc1ccc(cc1C(=O)O)(N+)(=O)(O)
InChI=1SC9H7NO6c15(11)168326(10(14)15)47(8)9(12)13h24H1H3(H1213)
MFCD00459608
ZINC000003163861
ZINC3163861
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