5,5'-dibromo-4,4'-didodecyl-2,2'-bithiophene

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Catalog Number

ACMA00016388

Product Name

5,5'-dibromo-4,4'-didodecyl-2,2'-bithiophene

Category

Other Materials

IUPAC Name

2-bromo-5-(5-bromo-4-dodecylthiophen-2-yl)-3-dodecylthiophene

Molecular Weight

660.7g/mol

Molecular Formula

C32H52Br2S2

Canonical SMILES

CCCCCCCCCCCCC1=C(SC(=C1)C2=CC(=C(S2)Br)CCCCCCCCCCCC)Br

InChI

InChI=1S/C32H52Br2S2/c1-3-5-7-9-11-13-15-17-19-21-23-27-25-29(35-31(27)33)30-26-28(32(34)36-30)24-22-20-18-16-14-12-10-8-6-4-2/h25-26H,3-24H2,1-2H3

InChI Key

HTSYYLNTMSXYHZ-UHFFFAOYSA-N

Complexity

459

Covalently-Bonded Unit Count

Exact Mass

660.18567g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

658.18772g/mol

Rotatable Bond Count

XLogP3

17.5

MSDS

COA

Spec Sheet

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