Vitas-M small molecule compound

3-hydroxy-2-methoxy-6,8-dioxabicyclo[3.2.1]oct-4-yl 4-methylbenzenesulfonate (non-preferred name)

Catalog ID
STK689421
SMILES COC1C2COC(O2)C(C1O)OS(=O)(=O)c1ccc(cc1)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 C14H18O7S MW 330.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18O7S/c1-8-3-5-9(6-4-8)22(16,17)21-13-11(15)12(18-2)10-7-19-14(13)20-10/h3-6,10-15H,7H2,1-2H3
InChIKey
NHNGITFELBRIPY-UHFFFAOYSA-N
Synonyms
(3hydroxy2methoxy68dioxabicyclo(321)octan4yl)4methylbenzenesulfonate
3hydroxy2methoxy68dioxabicyclo(321)oct4yl4methylbenzenesulfonate(nonpreferredname)
CC1=CC=C(C=C1)S(=O)(=O)OC2C(C(C3COC2O3)OC)O
Registry IDs
MFCD08532100
ZINC000103194812
ZINC000248024233

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Available files

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