Vitas-M small molecule compound

dimethyl 5-nitrobenzene-1,3-dicarboxylate

Catalog ID
STK387129
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)OC

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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)6-3-7(10(13)17-2)5-8(4-6)11(14)15/h3-5H,1-2H3
InChIKey
GGTSJKFPGKFLCZ-UHFFFAOYSA-N
Synonyms
13290-96-5
13290965
13BENZENEDICARBOXYLICACID5NITRO13DIMETHYLESTER
13BENZENEDICARBOXYLICACID5NITRODIMETHYLESTER
13DIMETHYL5NITROBENZENE13DICARBOXYLATE
15NITRODIMETHYLESTER
5NITRO13BENZENEDICARBOXYLICACIDDIMETHYLESTER
5NITRODIMETHYLISOPHTHALATE
5NITROISOPHTHALICACIDDIMETHYLESTER
COC(=O)C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)OC
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)OC
DIMETHYL5NITRO13BENZENEDICARBOXYLATE
dimethyl5nitrobenzene13dicarboxylate
DIMETHYL5NITROISOPHTHALATE
InChI=1SC10H9NO6c1169(12)637(10(13)172)58(46)11(14)15h35H12H3
ISOPHTHALICACID5NITRODIMETHYLESTER
ISOPHTHALICACID5NITRODIMETHYLESTER(6CI7CI8CI)
METHYL5(METHOXYCARBONYL)3NITROBENZOATE
MFCD00008429
ZINC000000056579
ZINC00056579
ZINC56579

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Available files

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