Vitas-M small molecule compound
2-(4-bromophenyl)-3,3,5-trimethyl-6-oxo-3,6-dihydro-2H-pyran-4-yl 4-chlorobenzenesulfonate
Catalog ID
STL004088
SMILES Clc1ccc(cc1)S(=O)(=O)OC1=C(C)C(=O)OC(C1(C)C)c1ccc(cc1)Br
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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 C20H18BrClO5S MW 485.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrClO5S/c1-12-17(27-28(24,25)16-10-8-15(22)9-11-16)20(2,3)18(26-19(12)23)13-4-6-14(21)7-5-13/h4-11,18H,1-3H3InChIKey
GSQLQHWXHOVGFS-UHFFFAOYSA-NSynonyms
433963-57-6(2(4BROMOPHENYL)335TRIMETHYL6OXO2HPYRAN4YL)4CHLOROBENZENESULFONATE
(2R)2(4BROMOPHENYL)335TRIMETHYL6OXO36DIHYDRO2HPYRAN4YL4CHLOROBENZENESULFONATE
2(4bromophenyl)335trimethyl6oxo36dihydro2Hpyran4yl4chlorobenzenesulfonate
433963576
CC1=C(C(C(OC1=O)C2=CC=C(C=C2)Br)(C)C)OS(=O)(=O)C3=CC=C(C=C3)Cl
InChI=1SC20H18BrClO5Sc11217(2728(2425)1610815(22)91116)20(23)18(2619(12)23)134614(21)7513h41118H13H3
MFCD03301736
ZINC000001738671
ZINC000001738675
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