Vitas-M small molecule compound

dimethyl 4-nitrobenzene-1,2-dicarboxylate

Catalog ID
STK731777
SMILES COC(=O)c1cc(ccc1C(=O)OC)[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 C10H9NO6 MW 239.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9NO6/c1-16-9(12)7-4-3-6(11(14)15)5-8(7)10(13)17-2/h3-5H,1-2H3
InChIKey
XWBDWELWBUWSNI-UHFFFAOYSA-N
Synonyms
610-22-0
12BENZENEDICARBOXYLICACID4NITRO12DIMETHYLESTER
12BENZENEDICARBOXYLICACID4NITRODIMETHYLESTER
12DIMETHYL4NITROBENZENE12DICARBOXYLATE
12DIMETHYL4NITROPHTHALATE
14NITRODIMETHYLESTER
35DIMETHYL4NITROPHTHALATE
4NITRODIMETHYLPHTHALATE
4NITROPHTHALICACIDDIMETHYLESTER
5NITROISOPHTHYLACIDDIMETHYLESTER
610220
COC(=O)C1=C(C=C(C=C1)(N+)(=O)(O))C(=O)OC
COC(=O)c1cc(ccc1C(=O)OC)(N+)(=O)(O)
DIMETHYL4NITRO12BENZENEDICARBOXYLATE
dimethyl4nitrobenzene12dicarboxylate
DIMETHYL4NITROPHTHALATE
InChI=1SC10H9NO6c1169(12)7436(11(14)15)58(7)10(13)172h35H12H3
METHYL2(METHOXYCARBONYL)4NITROBENZOATE
METHYL2(METHOXYCARBONYL)5NITROBENZOATE
MFCD00017191
PHTHALICACID4NITRODIMETHYLESTER
ZINC000000499735
ZINC00499735
ZINC499735

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Available files

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