Vitas-M small molecule compound
8-(3-bromo-4-ethoxybenzylidene)-6,10-dioxaspiro[4.5]decane-7,9-dione
Catalog ID
STK397185
SMILES CCOc1ccc(cc1Br)C=C1C(=O)OC2(OC1=O)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 C17H17BrO5 MW 381.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17BrO5/c1-2-21-14-6-5-11(10-13(14)18)9-12-15(19)22-17(23-16(12)20)7-3-4-8-17/h5-6,9-10H,2-4,7-8H2,1H3InChIKey
KKEDMIZUGZZCDI-UHFFFAOYSA-NSynonyms
8((3BROMO4ETHOXYPHENYL)METHYLENE)610DIOXASPIRO(45)DECANE79DIONE
8((3BROMO4ETHOXYPHENYL)METHYLIDENE)610DIOXASPIRO(45)DECANE79DIONE
8(3bromo4ethoxybenzylidene)610dioxaspiro(45)decane79dione
CCOC1=C(C=C(C=C1)C=C2C(=O)OC3(CCCC3)OC2=O)Br
InChI=1SC17H17BrO5c1221146511(1013(14)18)91215(19)2217(2316(12)20)734817h56910H2478H21H3
MFCD01970711
ZINC000004501857
ZINC04501857
ZINC4501857
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