Vitas-M small molecule compound
1-(2,3-dihydro-1,4-benzodioxin-6-yl)butan-1-one
Catalog ID
STK100449
SMILES CCCC(=O)c1ccc2c(c1)OCCO2
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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 C12H14O3 MW 206.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14O3/c1-2-3-10(13)9-4-5-11-12(8-9)15-7-6-14-11/h4-5,8H,2-3,6-7H2,1H3InChIKey
XSWZTOLEGWPAAA-UHFFFAOYSA-NSynonyms
29668-47-11(23DIHYDRO14BENZODIOXIN6YL)1BUTANONE
1(23DIHYDRO14BENZODIOXIN6YL)BUTAN1ONE
1(23DIHYDROBENZO(B)(14)DIOXIN6YL)BUTAN1ONE
29668471
CCCC(=O)C1=CC2=C(C=C1)OCCO2
InChI=1SC12H14O3c12310(13)9451112(89)15761411h458H2367H21H3
MFCD02601787
ZINC000004679140
ZINC04679140
ZINC4679140
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