Vitas-M small molecule compound

4-chloro-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]-3-(trifluoromethyl)aniline

Catalog ID
STK746730
SMILES Clc1ccc(cc1C(F)(F)F)/N=C/c1cc2OCOc2cc1[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 C15H8ClF3N2O4 MW 372.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H8ClF3N2O4/c16-11-2-1-9(4-10(11)15(17,18)19)20-6-8-3-13-14(25-7-24-13)5-12(8)21(22)23/h1-6H,7H2/b20-6+
InChIKey
XHCKJDBLAHRQIU-CGOBSMCZSA-N
Synonyms

4chloroN((E)(6nitro13benzodioxol5yl)methylidene)3(trifluoromethyl)aniline
Clc1ccc(cc1C(F)(F)F)N=Cc1cc2OCOc2cc1(N+)(=O)(O)
MFCD00741735
ZINC000001051304

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Available files

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