Vitas-M small molecule compound

7-nitro-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid

Catalog ID
STK739578
SMILES [O-][N+](=O)c1cc2OCCOc2cc1C(=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/c11-9(12)5-3-7-8(16-2-1-15-7)4-6(5)10(13)14/h3-4H,1-2H2,(H,11,12)
InChIKey
QBFGQHROZQJASA-UHFFFAOYSA-N
Synonyms
57672-33-0
(O)(N+)(=O)c1cc2OCCOc2cc1C(=O)O
23DIHYDRO7NITRO14BENZODIOXIN6CARBOXYLICACID
45(ETHYLENEDIOXY)2NITROBENZOICACID
57672330
6NITRO23DIHYDRO14BENZODIOXINE7CARBOXYLICACID
7NITRO14BENZODIOXANE6CARBOXYLICACID
7nitro23dihydro14benzodioxine6carboxylicacid
7NITRO23DIHYDROBENZO(14)DIOXINE6CARBOXYLICACID
7NITRO23DIHYDROBENZO(B)(14)DIOXINE6CARBOXYLICACID
7NITRO2H3HBENZO(E)14DIOXANE6CARBOXYLICACID
C1COC2=C(O1)C=C(C(=C2)(N+)(=O)(O))C(=O)O
InChI=1SC9H7NO6c119(12)5378(1621157)46(5)10(13)14h34H12H2(H1112)
MFCD01116988
ZINC000004205455
ZINC4205455

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Available files

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