132794-02-6
(Z)-2,3-DIHYDRO-3-((2-METHOXYPHENYL)METHYLENE)-4H-1-BENZOTHIOPYRAN-4-O NE 1,1-DIOXIDE
Name(Z)-2,3-DIHYDRO-3-((2-METHOXYPHENYL)METHYLENE)-4H-1-BENZOTHIOPYRAN-4-O NE 1,1-DIOXIDE
1Identification
【Name】
(Z)-2,3-DIHYDRO-3-((2-METHOXYPHENYL)METHYLENE)-4H-1-BENZOTHIOPYRAN-4-O NE 1,1-DIOXIDE
【CAS】
【MDL】
MFCD01663626
【English Synonyms】
【Formula】
C17 H14 O4 S
【MolWeight】
314.36
【Inchi】
InChI=1S/C17H14O4S/c1-21-15-8-4-2-6-12(15)10-13-11-22(19,20)16-9-5-3-7-14(16)17(13)18/h2-10H,11H2,1H3/b13-10+
【InChIKey】
InChIKey=OJYKFKKTLXEUFG-JLHYYAGUSA-N
【SMILES】
COc1ccccc1/C=C/2\CS(=O)(=O)c3ccccc3C2=O
【MOL File】
(Z)-2,3-DIHYDRO-3-((….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(Z)-2,3-DIHYDRO-3-((2-METHOXYPHENYL)METHYLENE)-4H-1-BENZOTHIOPYRAN-4-O NE 1,1-DIOXIDE.cml