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2,6-Bis(2MeSn)-4,8-bis(2-EH)benzo[1,2-b:4,5-b']dithiophene

Catalog Number
ACM1160823788-3
CAS Number
1160823-78-8
Product Name
2,6-Bis(2MeSn)-4,8-bis(2-EH)benzo[1,2-b:4,5-b']dithiophene
Structure
Category
Organic Light-Emitting Diode (OLED) Materials
IUPAC Name
[4,8-bis(2-ethylhexoxy)-2-trimethylstannylthieno[2,3-f][1]benzothiol-6-yl]-trimethylstannane
Molecular Weight
772.3g/mol
Molecular Formula
C32H54O2S2Sn2
Canonical SMILES
CCCCC(CC)COC1=C2C=C(SC2=C(C3=C1SC(=C3)[Sn](C)(C)C)OCC(CC)CCCC)[Sn](C)(C)C
InChI
InChI=1S/C26H36O2S2.6CH3.2Sn/c1-5-9-11-19(7-3)17-27-23-21-13-15-30-26(21)24(22-14-16-29-25(22)23)28-18-20(8-4)12-10-6-2;;;;;;;;/h13-14,19-20H,5-12,17-18H2,1-4H3;6*1H3;;
InChI Key
XXMOZDBOAIICDA-UHFFFAOYSA-N
Complexity
636
Covalently-Bonded Unit Count
1
Exact Mass
772.16033g/mol
Formal Charge
0
Heavy Atom Count
38
Monoisotopic Mass
774.16093g/mol
Rotatable Bond Count
16
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