Vitas-M small molecule compound

methyl 4-{2-[(3-nitrophenyl)carbonyl]hydrazinyl}-4-oxobutanoate

Catalog ID
STK073912
SMILES COC(=O)CCC(=O)NNC(=O)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 C12H13N3O6 MW 295.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N3O6/c1-21-11(17)6-5-10(16)13-14-12(18)8-3-2-4-9(7-8)15(19)20/h2-4,7H,5-6H2,1H3,(H,13,16)(H,14,18)
InChIKey
FDEDGAOGWVZFNZ-UHFFFAOYSA-N
Synonyms
304456-79-9
304456799
4(N(3NITROBENZOYL)HYDRAZINO)4OXOBUTYRICACIDMETHYLESTER
COC(=O)CCC(=O)NNC(=O)C1=CC(=CC=C1)(N+)(=O)(O)
COC(=O)CCC(=O)NNC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC12H13N3O6c12111(17)6510(16)131412(18)83249(78)15(19)20h247H56H21H3(H1316)(H1418)
METHYL4(2((3NITROPHENYL)CARBONYL)HYDRAZINYL)4OXOBUTANOATE
METHYL4(2(3NITROBENZOYL)HYDRAZINYL)4OXOBUTANOATE
MFCD00589684
STK073912
ZINC000001948032
ZINC01948032
ZINC1948032

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Available files

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