Vitas-M small molecule compound

4-(2,3-dihydro-1,4-benzodioxin-2-yl)-4-oxobutanoic acid

Catalog ID
STL525814
SMILES OC(=O)CCC(=O)C1COc2c(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 C12H12O5 MW 236.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12O5/c13-8(5-6-12(14)15)11-7-16-9-3-1-2-4-10(9)17-11/h1-4,11H,5-7H2,(H,14,15)
InChIKey
NONVECXGZXUMCC-UHFFFAOYSA-N
Synonyms
374701-57-2
3548085
374701572
4(23dihydro14benzodioxin2yl)4oxobutanoicacid
4(23DIHYDRO14BENZODIOXIN3YL)4OXOBUTANOICACID
4(23dihydrobenzo(b)(14)dioxin2yl)4oxobutanoicacid
InChI=1SC12H12O5c138(5612(14)15)117169312410(9)1711h1411H57H2(H1415)
MFCD00440739
ZINC000000518896
ZINC000000518897

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Available files

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