921938-87-6
(4-THIEN-2-YLTETRAHYDROPYRAN-4-YL)METHYL TOLUENE-4-SULFONATE
Name(4-THIEN-2-YLTETRAHYDROPYRAN-4-YL)METHYL TOLUENE-4-SULFONATE
1Identification
【Name】
(4-THIEN-2-YLTETRAHYDROPYRAN-4-YL)METHYL TOLUENE-4-SULFONATE
【CAS】
【MDL】
MFCD09879933
【EnglishSynonyms】
【pro_formula】
C17 H20 O4 S2
【pro_molWeight】
352.473
【Inchi】
InChI=1S/C17H20O4S2/c1-14-4-6-15(7-5-14)23(18,19)21-13-17(8-10-20-11-9-17)16-3-2-12-22-16/h2-7,12H,8-11,13H2,1H3
【InChIKey】
InChIKey=OZWQPINOYPXHPX-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)S(=O)(=O)OCC2(CCOCC2)c3cccs3
【MOL File】
(4-THIEN-2-YLTETRAHY….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:4
XLogP3:3.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
(4-THIEN-2-YLTETRAHYDROPYRAN-4-YL)METHYL TOLUENE-4-SULFONATE.cml