Vitas-M small molecule compound

4-[(4-methoxyphenyl)amino]-3,5-dinitrobenzoic acid

Catalog ID
STL503490
SMILES COc1ccc(cc1)Nc1c(cc(cc1[N+](=O)[O-])C(=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 C14H11N3O7 MW 333.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11N3O7/c1-24-10-4-2-9(3-5-10)15-13-11(16(20)21)6-8(14(18)19)7-12(13)17(22)23/h2-7,15H,1H3,(H,18,19)
InChIKey
KCASRWLLXCGCOO-UHFFFAOYSA-N
Synonyms

4((4methoxyphenyl)amino)35dinitrobenzoicacid
4(4methoxyanilino)35dinitrobenzoicacid
46707062
InChI=1SC14H11N3O7c12410429(3510)151311(16(20)21)68(14(18)19)712(13)17(22)23h2715H1H3(H1819)
MFCD31486903
ZINC000025501936
ZINC25501936

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Available files

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