Vitas-M small molecule compound

ethyl (5-nitro-1H-imidazol-4-yl)carbamate

Catalog ID
STL436925
SMILES [O-][N+](=O)c1c(NC(=O)OCC)nc[nH]1

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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 C6H8N4O4 MW 200.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H8N4O4/c1-2-14-6(11)9-4-5(10(12)13)8-3-7-4/h3H,2H2,1H3,(H,7,8)(H,9,11)
InChIKey
YDBBLKDJCIFNOG-UHFFFAOYSA-N
Synonyms
82039-89-2
(O)(N+)(=O)c1c(NC(=O)OCC)nc(nH)1
82039892
CCOC(=O)NC1=C(N=CN1)(N+)(=O)(O)
ethyl(5nitro1Himidazol4yl)carbamate
ETHYL5NITRO1HIMIDAZOL4YLCARBAMATE
ETHYLN(4NITRO1HIMIDAZOL5YL)CARBAMATE
InChI=1SC6H8N4O4c12146(11)945(10(12)13)8374h3H2H21H3(H78)(H911)
MFCD05739313
ZINC000004115065
ZINC04115065
ZINC4115065

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Available files

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