Vitas-M small molecule compound
(2E)-1-(4-chloro-2-hydroxyphenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one
Catalog ID
STL322831
SMILES Clc1ccc(c(c1)O)C(=O)/C=C/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 C17H13ClO4 MW 316.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClO4/c18-12-3-4-13(15(20)10-12)14(19)5-1-11-2-6-16-17(9-11)22-8-7-21-16/h1-6,9-10,20H,7-8H2/b5-1+InChIKey
HXPUNVAMLYFSLK-ORCRQEGFSA-NSynonyms
96755-02-1(2E)1(4chloro2hydroxyphenyl)3(23dihydro14benzodioxin6yl)prop2en1one
(E)1(4CHLORO2HYDROXYPHENYL)3(23DIHYDRO14BENZODIOXIN6YL)PROP2EN1ONE
(E)1(4chloro2hydroxyphenyl)3(23dihydrobenzo(b)(14)dioxin6yl)prop2en1one
96755021
C1COC2=C(O1)C=CC(=C2)C=CC(=O)C3=C(C=C(C=C3)Cl)O
Clc1ccc(c(c1)O)C(=O)C=Cc1ccc2c(c1)OCCO2
InChI=1SC17H13ClO4c18123413(15(20)1012)14(19)5111261617(911)22872116h1691020H78H2b51+
MFCD00101644
ZINC000004070532
ZINC04070532
ZINC4070532
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