Vitas-M small molecule compound

methyl 4-(3-nitrophenyl)-2,4-dioxobutanoate

Catalog ID
STK312239
SMILES COC(=O)C(=O)CC(=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 C11H9NO6 MW 251.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9NO6/c1-18-11(15)10(14)6-9(13)7-3-2-4-8(5-7)12(16)17/h2-5H,6H2,1H3
InChIKey
QYSCKGUZJUBRDG-UHFFFAOYSA-N
Synonyms
345617-18-7
345617187
4(3NITROPHENYL)24DIOXOBUTYRICACIDMETHYLE
4(3NITROPHENYL)24DIOXOBUTYRICACIDMETHYLESTER
COC(=O)C(=O)CC(=O)C1=CC(=CC=C1)(N+)(=O)(O)
COC(=O)C(=O)CC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC11H9NO6c11811(15)10(14)69(13)73248(57)12(16)17h25H6H21H3
methyl4(3nitrophenyl)24dioxobutanoate
METHYLNITROPHENYLDIOXOBUTANOATE
MFCD02725697
ZINC000100025138
ZINC100025138

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Available files

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