Vitas-M small molecule compound

ethyl 6-bromo-5-[(2-methylprop-2-en-1-yl)oxy]-2-phenyl-1-benzofuran-3-carboxylate

Catalog ID
STK888165
SMILES CCOC(=O)c1c(oc2c1cc(OCC(=C)C)c(c2)Br)c1ccccc1

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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 C21H19BrO4 MW 415.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrO4/c1-4-24-21(23)19-15-10-18(25-12-13(2)3)16(22)11-17(15)26-20(19)14-8-6-5-7-9-14/h5-11H,2,4,12H2,1,3H3
InChIKey
IXUWIOYFOCCZHH-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OCC(=C)C)Br)C3=CC=CC=C3
ethyl6bromo5((2methylprop2en1yl)oxy)2phenyl1benzofuran3carboxylate
ETHYL6BROMO5(2METHYLPROP2ENOXY)2PHENYL1BENZOFURAN3CARBOXYLATE
ETHYL6BROMO5(2METHYLPROP2ENYLOXY)2PHENYLBENZO(B)FURAN3CARBOXYLATE
InChI=1SC21H19BrO4c142421(23)19151018(251213(2)3)16(22)1117(15)2620(19)148657914h511H2412H213H3
MFCD03465203
ZINC000001463670
ZINC01463670
ZINC1463670

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Available files

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