Vitas-M small molecule compound

N-(2,6-dichloro-4-nitrophenyl)-3,5-dinitrobenzamide

Catalog ID
STK081686
SMILES Clc1cc(cc(c1NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])Cl)[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 C13H6Cl2N4O7 MW 401.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H6Cl2N4O7/c14-10-4-9(19(25)26)5-11(15)12(10)16-13(20)6-1-7(17(21)22)3-8(2-6)18(23)24/h1-5H,(H,16,20)
InChIKey
UXWBCBLRRHXXKI-UHFFFAOYSA-N
Synonyms

C1=C(C=C(C=C1(N+)(=O)(O))(N+)(=O)(O))C(=O)NC2=C(C=C(C=C2Cl)(N+)(=O)(O))Cl
Clc1cc(cc(c1NC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O))Cl)(N+)(=O)(O)
InChI=1SC13H6Cl2N4O7c141049(19(25)26)511(15)12(10)1613(20)617(17(21)22)38(26)18(23)24h15H(H1620)
MFCD00364121
N(26DICHLORO4NITROPHENYL)35DINITROBENZAMIDE
STK081686
ZINC000101483087
ZINC101483087

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Available files

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