Vitas-M small molecule compound

methyl 4-(1-benzofuran-2-yl)-4-oxobutanoate

Catalog ID
STK731399
SMILES COC(=O)CCC(=O)c1cc2c(o1)cccc2

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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 C13H12O4 MW 232.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12O4/c1-16-13(15)7-6-10(14)12-8-9-4-2-3-5-11(9)17-12/h2-5,8H,6-7H2,1H3
InChIKey
BWMLPJNDFRIQHE-UHFFFAOYSA-N
Synonyms
293765-91-0
293765910
COC(=O)CCC(=O)C1=CC2=CC=CC=C2O1
InChI=1SC13H12O4c11613(15)7610(14)1289423511(9)1712h258H67H21H3
methyl4(1benzofuran2yl)4oxobutanoate
methyl4(benzofuran2yl)4oxobutanoate
METHYL4BENZO(D)FURAN2YL4OXOBUTANOATE
MFCD00438733
ZINC000000052314
ZINC00052314
ZINC52314

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Available files

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