Vitas-M small molecule compound

(2E)-1-(3,5-dichloro-2-hydroxyphenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one

Catalog ID
STL322528
SMILES Clc1cc(Cl)c(c(c1)C(=O)/C=C/c1ccc2c(c1)OCCO2)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 C17H12Cl2O4 MW 351.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12Cl2O4/c18-11-8-12(17(21)13(19)9-11)14(20)3-1-10-2-4-15-16(7-10)23-6-5-22-15/h1-4,7-9,21H,5-6H2/b3-1+
InChIKey
GLNBFKYBWUXCLZ-HNQUOIGGSA-N
Synonyms
106584-18-3
(2E)1(35DICHLORO2HYDROXYPHENYL)3(23DIHYDRO14BENZODIOXIN6YL)PROP2EN1ONE
(E)1(35DICHLORO2HYDROXYPHENYL)3(23DIHYDRO14BENZODIOXIN6YL)PROP2EN1ONE
(E)1(35dichloro2hydroxyphenyl)3(23dihydrobenzo(b)(14)dioxin6yl)prop2en1one
106584183
C1COC2=C(O1)C=CC(=C2)C=CC(=O)C3=CC(=CC(=C3O)Cl)Cl
Clc1cc(Cl)c(c(c1)C(=O)C=Cc1ccc2c(c1)OCCO2)O
InChI=1SC17H12Cl2O4c1811812(17(21)13(19)911)14(20)3110241516(710)23652215h147921H56H2b31+
ZINC04771370
ZINC4771370

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Available files

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