Vitas-M small molecule compound
4-(dimethylamino)-3,5-dinitrobenzoic acid
Catalog ID
STL495497
SMILES [O-][N+](=O)c1cc(cc(c1N(C)C)[N+](=O)[O-])C(=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 C9H9N3O6 MW 255.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H9N3O6/c1-10(2)8-6(11(15)16)3-5(9(13)14)4-7(8)12(17)18/h3-4H,1-2H3,(H,13,14)InChIKey
HPESPZDCCQMDOO-UHFFFAOYSA-NSynonyms
82366-55-0(O)(N+)(=O)c1cc(cc(c1N(C)C)(N+)(=O)(O))C(=O)O
2DIMETHYLAMINO35DINITROBENZOICACID
4(DIMETHYLAMINO)35DINITROBENZOICACID
4DIMETHYLAMINO35DINITROBENZOICACID
82366550
CN(C)C1=C(C=C(C=C1(N+)(=O)(O))C(=O)O)(N+)(=O)(O)
InChI=1SC9H9N3O6c110(2)86(11(15)16)35(9(13)14)47(8)12(17)18h34H12H3(H1314)
MFCD00024508
ZINC000003877745
ZINC3877745
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