Vitas-M small molecule compound
2-[(4-methylphenyl)amino]-3,5-dinitrobenzoic acid
Catalog ID
STL195638
SMILES Cc1ccc(cc1)Nc1c(cc(cc1[N+](=O)[O-])[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 C14H11N3O6 MW 317.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11N3O6/c1-8-2-4-9(5-3-8)15-13-11(14(18)19)6-10(16(20)21)7-12(13)17(22)23/h2-7,15H,1H3,(H,18,19)InChIKey
QHHQGAVEOAJNIE-UHFFFAOYSA-NSynonyms
65462-56-82((4methylphenyl)amino)35dinitrobenzoicacid
2(4METHYLANILINO)35DINITROBENZOICACID
65462568
CC1=CC=C(C=C1)NC2=C(C=C(C=C2C(=O)O)(N+)(=O)(O))(N+)(=O)(O)
Cc1ccc(cc1)Nc1c(cc(cc1(N+)(=O)(O))(N+)(=O)(O))C(=O)O
InChI=1SC14H11N3O6c18249(538)151311(14(18)19)610(16(20)21)712(13)17(22)23h2715H1H3(H1819)
MFCD02376084
ZINC000005588709
ZINC5588709
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