Vitas-M small molecule compound
ethyl 6-[(4-bromophenyl)carbonyl]-6-ethyl-4,4-dimethyl-2-oxo-3-oxabicyclo[3.1.0]hexane-1-carboxylate
Catalog ID
STK770862
SMILES CCOC(=O)C12C(=O)OC(C1C2(CC)C(=O)c1ccc(cc1)Br)(C)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 C19H21BrO5 MW 409.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21BrO5/c1-5-18(13(21)11-7-9-12(20)10-8-11)14-17(3,4)25-16(23)19(14,18)15(22)24-6-2/h7-10,14H,5-6H2,1-4H3InChIKey
HHJZEZAEEBZHAM-UHFFFAOYSA-NSynonyms
474264-11-4474264114
CCC1(C2C1(C(=O)OC2(C)C)C(=O)OCC)C(=O)C3=CC=C(C=C3)Br
ETHYL6((4BROMOPHENYL)CARBONYL)6ETHYL44DIMETHYL2OXO3OXABICYCLO(310)HEXANE1CARBOXYLATE
ETHYL6(4BROMOBENZOYL)6ETHYL22DIMETHYL4OXO3OXABICYCLO(310)HEXANE5CARBOXYLATE
ethyl6(4bromobenzoyl)6ethyl44dimethyl2oxo3oxabicyclo(310)hexane1carboxylate
InChI=1SC19H21BrO5c1518(13(21)117912(20)10811)1417(34)2516(23)19(1418)15(22)2462h71014H56H214H3
MFCD03266431
ZINC000004029756
ZINC000100641790
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