Vitas-M small molecule compound

N-tert-butyl-2-hydroxy-3,5-dinitrobenzamide

Catalog ID
STK365824
SMILES [O-][N+](=O)c1cc(C(=O)NC(C)(C)C)c(c(c1)[N+](=O)[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 C11H13N3O6 MW 283.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13N3O6/c1-11(2,3)12-10(16)7-4-6(13(17)18)5-8(9(7)15)14(19)20/h4-5,15H,1-3H3,(H,12,16)
InChIKey
GXGCEJJMLXOQAC-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cc(C(=O)NC(C)(C)C)c(c(c1)(N+)(=O)(O))O
CC(C)(C)NC(=O)C1=CC(=CC(=C1O)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC11H13N3O6c111(23)1210(16)746(13(17)18)58(9(7)15)14(19)20h4515H13H3(H1216)
MFCD00426675
Ntertbutyl2hydroxy35dinitrobenzamide
ZINC000003156562
ZINC3156562

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Available files

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