Vitas-M small molecule compound

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

Catalog ID
STK887986
SMILES CCOC(=O)c1c(oc2c1cc(OC(=O)C(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 C21H19BrO5 MW 431.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrO5/c1-4-25-21(24)18-14-10-17(27-20(23)12(2)3)15(22)11-16(14)26-19(18)13-8-6-5-7-9-13/h5-12H,4H2,1-3H3
InChIKey
ROLXXSDNXCGGNK-UHFFFAOYSA-N
Synonyms

6BROMO3(ETHOXYCARBONYL)2PHENYLBENZO(B)FURAN5YL2METHYLPROPANOATE
CCOC(=O)C1=C(OC2=CC(=C(C=C21)OC(=O)C(C)C)Br)C3=CC=CC=C3
ethyl6bromo5((2methylpropanoyl)oxy)2phenyl1benzofuran3carboxylate
ETHYL6BROMO5(2METHYLPROPANOYLOXY)2PHENYL1BENZOFURAN3CARBOXYLATE
InChI=1SC21H19BrO5c142521(24)18141017(2720(23)12(2)3)15(22)1116(14)2619(18)138657913h512H4H213H3
MFCD02166985
ZINC000000623857
ZINC00623857
ZINC623857

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Available files

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