Vitas-M small molecule compound
tert-butyl {[(2Z)-2-(4-bromobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetate
Catalog ID
STK625135
SMILES O=C(OC(C)(C)C)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)Br)/C2=O
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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/c1-21(2,3)27-19(23)12-25-15-8-9-16-17(11-15)26-18(20(16)24)10-13-4-6-14(22)7-5-13/h4-11H,12H2,1-3H3/b18-10-InChIKey
XMSKRBXKPBYLFE-ZDLGFXPLSA-NSynonyms
620548-06-3(Z)tertbutyl2((2(4bromobenzylidene)3oxo23dihydrobenzofuran6yl)oxy)acetate
620548063
CC(C)(C)OC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=CC=C(C=C3)Br)O2
InChI=1SC21H19BrO5c121(23)2719(23)122515891617(1115)2618(20(16)24)10134614(22)7513h411H12H213H3b1810
MFCD04169907
O=C(OC(C)(C)C)COc1ccc2c(c1)OC(=Cc1ccc(cc1)Br)C2=O
tertbutyl(((2Z)2(4bromobenzylidene)3oxo23dihydro1benzofuran6yl)oxy)acetate
TERTBUTYL2(((2Z)2((4BROMOPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXY)ACETATE
TERTBUTYL2(2((4BROMOPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)ACETATE
ZINC000009486747
ZINC09486747
ZINC9486747
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