Vitas-M small molecule compound

ethyl [5-(3-nitrophenyl)-2H-tetrazol-2-yl]acetate

Catalog ID
STK667472
SMILES CCOC(=O)Cn1nnc(n1)c1cccc(c1)[N+](=O)[O-]

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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 C11H11N5O4 MW 277.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11N5O4/c1-2-20-10(17)7-15-13-11(12-14-15)8-4-3-5-9(6-8)16(18)19/h3-6H,2,7H2,1H3
InChIKey
XCZHCMAFJSVKNW-UHFFFAOYSA-N
Synonyms

CCOC(=O)CN1N=C(N=N1)C2=CC(=CC=C2)(N+)(=O)(O)
CCOC(=O)Cn1nnc(n1)c1cccc(c1)(N+)(=O)(O)
ethyl(5(3nitrophenyl)2Htetrazol2yl)acetate
ETHYL2(5(3NITROPHENYL)TETRAZOL2YL)ACETATE
InChI=1SC11H11N5O4c122010(17)7151311(121415)84359(68)16(18)19h36H27H21H3
MFCD00276899
ZINC000000090102
ZINC00090102
ZINC90102

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Available files

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