365547-21-3
2,6-DIBROMO-4,4-BIS(2-ETHYLHEXYL)-4H-CYCLOPENTA[2,1-B:3,4-B']DITHIOPHENE
Name2,6-DIBROMO-4,4-BIS(2-ETHYLHEXYL)-4H-CYCLOPENTA[2,1-B:3,4-B']DITHIOPHENE
1Identification
【Name】
2,6-DIBROMO-4,4-BIS(2-ETHYLHEXYL)-4H-CYCLOPENTA[2,1-B:3,4-B']DITHIOPHENE
【CAS】
【MDL】
MFCD16619302
【English Synonyms】
【Formula】
C25 H36 Br2 S2
【MolWeight】
560.499
【Inchi】
InChI=1S/C25H36Br2S2/c1-5-9-11-17(7-3)15-25(16-18(8-4)12-10-6-2)19-13-21(26)28-23(19)24-20(25)14-22(27)29-24/h13-14,17-18H,5-12,15-16H2,1-4H3
【InChIKey】
InChIKey=NEQRAFHWWLGKEJ-UHFFFAOYSA-N
【SMILES】
CCCCC(CC)CC1(c2cc(sc2-c3c1cc(s3)Br)Br)CC(CC)CCCC
【MOL File】
2,6-DIBROMO-4,4-BIS(….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:13.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,6-DIBROMO-4,4-BIS(2-ETHYLHEXYL)-4H-CYCLOPENTA[2,1-B:3,4-B']DITHIOPHENE.cml