Vitas-M small molecule compound

3,5-dinitro-4-(phenylamino)benzoic acid

Catalog ID
STL503480
SMILES OC(=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])Nc1ccccc1

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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 C13H9N3O6 MW 303.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9N3O6/c17-13(18)8-6-10(15(19)20)12(11(7-8)16(21)22)14-9-4-2-1-3-5-9/h1-7,14H,(H,17,18)
InChIKey
MDPOBYVJWFEBRC-UHFFFAOYSA-N
Synonyms

14811547
35dinitro4(phenylamino)benzoicacid
4anilino35dinitrobenzoicacid
InChI=1SC13H9N3O6c1713(18)8610(15(19)20)12(11(78)16(21)22)149421359h1714H(H1718)
MFCD00157003
ZINC000034370509
ZINC34370509

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Available files

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