Vitas-M small molecule compound

4-nitrobenzene-1,2-dicarboxylic acid

Catalog ID
STK397442
SMILES OC(=O)c1cc(ccc1C(=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 C8H5NO6 MW 211.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H5NO6/c10-7(11)5-2-1-4(9(14)15)3-6(5)8(12)13/h1-3H,(H,10,11)(H,12,13)
InChIKey
SLBQXWXKPNIVSQ-UHFFFAOYSA-N
Synonyms
610-27-5
12BENZENEDICARBOXYLICACID4NITRO
4NITRO12BENZENEDICARBOXYLICACID
4nitrobenzene12dicarboxylicacid
4NITROPHTHALICACID
5NITROPHTHALICACID
610275
C1=CC(=C(C=C1(N+)(=O)(O))C(=O)O)C(=O)O
InChI=1SC8H5NO6c107(11)5214(9(14)15)36(5)8(12)13h13H(H1011)(H1213)
MFCD00007252
OC(=O)c1cc(ccc1C(=O)O)(N+)(=O)(O)
PHTHALICACID4NITRO
PNITROPHTHALICACID
ZINC000000157056
ZINC157056

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Available files

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