Vitas-M small molecule compound

N-(2,2-dimethoxyethyl)-4-nitro-2,1,3-benzoxadiazol-5-amine

Catalog ID
STK834957
SMILES COC(CNc1ccc2c(c1[N+](=O)[O-])non2)OC

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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 C10H12N4O5 MW 268.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H12N4O5/c1-17-8(18-2)5-11-7-4-3-6-9(13-19-12-6)10(7)14(15)16/h3-4,8,11H,5H2,1-2H3
InChIKey
JMAICKXCVRNZME-UHFFFAOYSA-N
Synonyms
374095-44-0
374095440
COC(CNC1=C(C2=NON=C2C=C1)(N+)(=O)(O))OC
COC(CNc1ccc2c(c1(N+)(=O)(O))non2)OC
InChI=1SC10H12N4O5c1178(182)51174369(1319126)10(7)14(15)16h34811H5H212H3
MFCD01856493
N(22dimethoxyethyl)4nitro213benzoxadiazol5amine
N(22dimethoxyethyl)4nitrobenzo(c)(125)oxadiazol5amine
ZINC000004131804
ZINC04131804
ZINC4131804

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Available files

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