Vitas-M small molecule compound

4-amino-3,5-dinitrobenzamide

Catalog ID
STK365711
SMILES [O-][N+](=O)c1cc(cc(c1N)[N+](=O)[O-])C(=O)N

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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 C7H6N4O5 MW 226.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H6N4O5/c8-6-4(10(13)14)1-3(7(9)12)2-5(6)11(15)16/h1-2H,8H2,(H2,9,12)
InChIKey
BNVZFENSTYWDDB-UHFFFAOYSA-N
Synonyms
54321-79-8
(O)(N+)(=O)c1cc(cc(c1N)(N+)(=O)(O))C(=O)N
4amino35dinitrobenzamide
54321798
BENZAMIDE4AMINO35DINITRO
C1=C(C=C(C(=C1(N+)(=O)(O))N)(N+)(=O)(O))C(=O)N
InChI=1SC7H6N4O5c864(10(13)14)13(7(9)12)25(6)11(15)16h12H8H2(H2912)
MFCD00008001
ZINC000004013989
ZINC04013989
ZINC4013989

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Available files

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