Vitas-M small molecule compound

ethyl 3-(nitroamino)-1H-1,2,4-triazole-5-carboxylate

Catalog ID
STK752460
SMILES [O-][N+](=O)Nc1nc([nH]n1)C(=O)OCC

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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 C5H7N5O4 MW 201.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C5H7N5O4/c1-2-14-4(11)3-6-5(8-7-3)9-10(12)13/h2H2,1H3,(H2,6,7,8,9)
InChIKey
KSDZUECVPGJWAP-UHFFFAOYSA-N
Synonyms
294873-33-9
(O)(N+)(=O)Nc1nc((nH)n1)C(=O)OCC
1H124TRIAZOLE3CARBOXYLICACID5(NITROAMINO)ETHYLESTER
1H124TRIAZOLE3CARBOXYLICACID5ETHYLESTER
294873339
CCOC(=O)C1=NC(=NN1)N(N+)(=O)(O)
ethyl3(nitroamino)1H124triazole5carboxylate
ETHYL3NITRAMIDO1H124TRIAZOLE5CARBOXYLATE
InChI=1SC5H7N5O4c12144(11)365(873)910(12)13h2H21H3(H26789)
MFCD00820489
ZINC000001023501
ZINC1023501

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Available files

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