Vitas-M small molecule compound

ethyl (3-nitro-1H-1,2,4-triazol-1-yl)acetate

Catalog ID
STK343962
SMILES [O-][N+](=O)c1nn(cn1)CC(=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 C6H8N4O4 MW 200.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H8N4O4/c1-2-14-5(11)3-9-4-7-6(8-9)10(12)13/h4H,2-3H2,1H3
InChIKey
IJKYMLBNYHCLIH-UHFFFAOYSA-N
Synonyms
70965-24-1
(3NITRO(124)TRIAZOL1YL)ACETICACIDETHYLES
(3NITRO(124)TRIAZOL1YL)ACETICACIDETHYLESTER
(O)(N+)(=O)c1nn(cn1)CC(=O)OCC
1H124TRIAZOLE1ACETICACID3NITROETHYLESTER
70965241
CCOC(=O)CN1C=NC(=N1)(N+)(=O)(O)
ETHYL(3NITRO1H124TRIAZOL1YL)ACETATE
ETHYL2(3NITRO124TRIAZOL1YL)ACETATE
ETHYL2(3NITRO124TRIAZOLYL)ACETATE
ethyl2(3nitro1H124triazol1yl)acetate
InChI=1SC6H8N4O4c12145(11)39476(89)10(12)13h4H23H21H3
MFCD00297199
ZINC000001094008
ZINC01094008
ZINC1094008

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Available files

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