528870-51-1
2,2',3,3'-TETRAHYDRO-[5,5'-BITHIENO[3,4-B]-1,4-DIOXIN]-7,7'-DICARBOXALDEHYDE
Name2,2',3,3'-TETRAHYDRO-[5,5'-BITHIENO[3,4-B]-1,4-DIOXIN]-7,7'-DICARBOXALDEHYDE
1Identification
【Name】
2,2',3,3'-TETRAHYDRO-[5,5'-BITHIENO[3,4-B]-1,4-DIOXIN]-7,7'-DICARBOXALDEHYDE
【CAS】
【MDL】
MFCD08276896
【English Synonyms】
【Formula】
C14 H10 O6 S2
【MolWeight】
338.359
【Inchi】
InChI=1S/C14H10O6S2/c15-5-7-9-11(19-3-1-17-9)13(21-7)14-12-10(8(6-16)22-14)18-2-4-20-12/h5-6H,1-4H2
【InChIKey】
InChIKey=URGHWHMUSCLDJO-UHFFFAOYSA-N
【SMILES】
C1COc2c(c(sc2c3c4c(c(s3)C=O)OCCO4)C=O)O1
【MOL File】
2,2',3,3'-TETRAHYDRO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,2',3,3'-TETRAHYDRO-[5,5'-BITHIENO[3,4-B]-1,4-DIOXIN]-7,7'-DICARBOXALDEHYDE.cml