Vitas-M small molecule compound

propan-2-yl 6-bromo-5-(3,3-dimethyl-2-oxobutoxy)-2-methyl-1-benzofuran-3-carboxylate

Catalog ID
STK840533
SMILES CC(OC(=O)c1c(C)oc2c1cc(OCC(=O)C(C)(C)C)c(c2)Br)C

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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 C19H23BrO5 MW 411.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23BrO5/c1-10(2)24-18(22)17-11(3)25-14-8-13(20)15(7-12(14)17)23-9-16(21)19(4,5)6/h7-8,10H,9H2,1-6H3
InChIKey
OZXBJEWGALTNBA-UHFFFAOYSA-N
Synonyms
308295-99-0
308295990
CC1=C(C2=CC(=C(C=C2O1)Br)OCC(=O)C(C)(C)C)C(=O)OC(C)C
InChI=1SC19H23BrO5c110(2)2418(22)1711(3)2514813(20)15(712(14)17)23916(21)19(45)6h7810H9H216H3
ISOPROPYL6BROMO5(33DIMETHYL2OXOBUTOXY)2METHYLBENZOFURAN3CARBOXYLATE
METHYLETHYL5(33DIMETHYL2OXOBUTOXY)6BROMO2METHYLBENZO(B)FURAN3CARBOXYLATE
MFCD02167045
propan2yl6bromo5(33dimethyl2oxobutoxy)2methyl1benzofuran3carboxylate
ZINC000000623944
ZINC00623944
ZINC623944

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Available files

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