267007-83-0
S,S'-[1,4-PHENYLENEBIS(2,1-ETHYNEDIYL-4,1-PHENYLENE)]BIS(THIOACETATE)
Name
S,S'-[1,4-PHENYLENEBIS(2,1-ETHYNEDIYL-4,1-PHENYLENE)]BIS(THIOACETATE)
Formula
C26 H18 O2 S2
MolWeight
426.558
1Identification
【Name】
S,S'-[1,4-PHENYLENEBIS(2,1-ETHYNEDIYL-4,1-PHENYLENE)]BIS(THIOACETATE)
【CAS】
【MDL】
MFCD16621452
【English Synonyms】
【Formula】
C26 H18 O2 S2
【MolWeight】
426.558
【Inchi】
InChI=1S/C26H18O2S2/c1-19(27)29-25-15-11-23(12-16-25)9-7-21-3-5-22(6-4-21)8-10-24-13-17-26(18-14-24)30-20(2)28/h3-6,11-18H,1-2H3
【InChIKey】
InChIKey=HTBKJDXAIPKGEY-UHFFFAOYSA-N
【SMILES】
CC(=O)Sc1ccc(cc1)C#Cc2ccc(cc2)C#Cc3ccc(cc3)SC(=O)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
【WGK Germany】
3