Vitas-M small molecule compound

N-(2-chlorophenyl)-5,7-dinitro-2,1,3-benzoxadiazol-4-amine

Catalog ID
STK369478
SMILES [O-][N+](=O)c1cc([N+](=O)[O-])c2c(c1Nc1ccccc1Cl)non2

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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 C12H6ClN5O5 MW 335.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H6ClN5O5/c13-6-3-1-2-4-7(6)14-10-8(17(19)20)5-9(18(21)22)11-12(10)16-23-15-11/h1-5,14H
InChIKey
GWBVHJTWKKJWOB-UHFFFAOYSA-N
Synonyms

(57DINITROBENZO(C)125OXADIAZOL4YL)(2CHLOROPHENYL)AMINE
(O)(N+)(=O)c1cc((N+)(=O)(O))c2c(c1Nc1ccccc1Cl)non2
C1=CC=C(C(=C1)NC2=C(C=C(C3=NON=C23)(N+)(=O)(O))(N+)(=O)(O))Cl
InChI=1SC12H6ClN5O5c13631247(6)14108(17(19)20)59(18(21)22)1112(10)16231511h1514H
MFCD00392266
N(2chlorophenyl)57dinitro213benzoxadiazol4amine
ZINC000004017571
ZINC04017571
ZINC4017571

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Available files

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