79223-80-6
2,6-BIS-(4-CHLORO-PHENYL)-TETRAHYDRO-THIOPYRAN-4-ONE
Name2,6-BIS-(4-CHLORO-PHENYL)-TETRAHYDRO-THIOPYRAN-4-ONE
1Identification
【Name】
2,6-BIS-(4-CHLORO-PHENYL)-TETRAHYDRO-THIOPYRAN-4-ONE
【CAS】
【MDL】
MFCD10000631
【English Synonyms】
【Formula】
C17 H14 Cl2 O S
【MolWeight】
337.269
【Inchi】
InChI=1S/C17H14Cl2OS/c18-13-5-1-11(2-6-13)16-9-15(20)10-17(21-16)12-3-7-14(19)8-4-12/h1-8,16-17H,9-10H2
【InChIKey】
InChIKey=UVJXNQLZLRWRDN-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1C2CC(=O)CC(S2)c3ccc(cc3)Cl)Cl
【MOL File】
2,6-BIS-(4-CHLORO-PH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:4.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2,6-BIS-(4-CHLORO-PHENYL)-TETRAHYDRO-THIOPYRAN-4-ONE.cml