Vitas-M small molecule compound

2,4,6-trinitro-N-phenylaniline

Catalog ID
STK257463
SMILES [O-][N+](=O)c1cc(cc(c1Nc1ccccc1)[N+](=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 C12H8N4O6 MW 304.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H8N4O6/c17-14(18)9-6-10(15(19)20)12(11(7-9)16(21)22)13-8-4-2-1-3-5-8/h1-7,13H
InChIKey
GHWYJRRNNWVCPM-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cc(cc(c1Nc1ccccc1)(N+)(=O)(O))(N+)(=O)(O)
246TRINITRODIPHENYLAMINE
246TRINITRONPHENYLANILINE
BENZENAMINE246TRINITRONPHENYL
C1=CC=C(C=C1)NC2=C(C=C(C=C2(N+)(=O)(O))(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC12H8N4O6c1714(18)9610(15(19)20)12(11(79)16(21)22)138421358h1713H
MFCD00024418
ZINC000033354041
ZINC33354041

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Available files

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