5,5'''''-Dihexyl-2,2':5',2'':5'',2''':5''',2'''':5'''',2'''''-Sexithiophene
[CAS# 151271-43-1]

Identification

• Name: 5,5'''''-Dihexyl-2,2':5',2'':5'',2''':5''',2'''':5'''',2'''''-Sexithiophene
• Synonyms: 5,5′′′′-Dihexyl-2,2′:5′,2′′:5′′,2′′′:5′′′,2′′′′:5′′′′,2′′′′′-sexithiophene; 55''''-DIHEXYL-22':5'2'':5''2''':5'; DH-6T
• Molecular Formula: C₃₆H₃₈S₆
• Molecular Weight: 663.08
• CAS Registry Number: 151271-43-1
• SMILES: CCCCCCc1ccc(s1)c2ccc(s2)c3ccc(s3)c4ccc(s4)c5ccc(s5)c6ccc(s6)CCCCCC
• InChI: 1S/C36H38S6/c1-3-5-7-9-11-25-13-15-27(37-25)29-17-19-31(39-29)33-21-23-35(41-33)36-24-22-34(42-36)32-20-18-30(40-32)28-16-14-26(38-28)12-10-8-6-4-2/h13-24H,3-12H2,1-2H3
• InChIKey: QCMASTUHHXPVGT-UHFFFAOYSA-N

Properties

• Density: 1.205g/cm³ (Cal.)
• Boiling point: 700.922°C at 760 mmHg (Cal.)
• Flash point: 289.292°C (Cal.)
• Refractive index: 1.629 (Cal.)

References

• (1): Babudri Francesco. Fluorinated organic materials for electronic and optoelectronic applications: the role of the fluorine atom, Chemical Communications, 2007