Vitas-M small molecule compound

(2E)-1-(2,5-dimethoxyphenyl)-3-(3-hydroxyphenyl)prop-2-en-1-one

Catalog ID
STK506883
SMILES COc1ccc(c(c1)C(=O)/C=C/c1cccc(c1)O)OC

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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 C17H16O4 MW 284.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16O4/c1-20-14-7-9-17(21-2)15(11-14)16(19)8-6-12-4-3-5-13(18)10-12/h3-11,18H,1-2H3/b8-6+
InChIKey
NVALHAKCWQPQGM-SOFGYWHQSA-N
Synonyms

(2E)1(25dimethoxyphenyl)3(3hydroxyphenyl)prop2en1one
(E)1(25DIMETHOXYPHENYL)3(3HYDROXYPHENYL)PROP2EN1ONE
COC1=CC(=C(C=C1)OC)C(=O)C=CC2=CC(=CC=C2)O
COc1ccc(c(c1)C(=O)C=Cc1cccc(c1)O)OC
InChI=1SC17H16O4c120147917(212)15(1114)16(19)861243513(18)1012h31118H12H3b86+
MFCD06286843
ZINC000007744816
ZINC07744816
ZINC7744816

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Available files

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