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ChemicalBook--->CAS DataBase List--->1693-86-3

1693-86-3

1693-86-3 Structure

1693-86-3 Structure
IdentificationMore
[Name]

3-Hexylthiophene
[CAS]

1693-86-3
[Synonyms]

3-HEXYLTHIOPHENE
3-N-HEXYLTHIOPHENE
HEXYLTHIOPHENE(3-)
3-HEXYLTHIOPHENE, 99+%
3-HEXYLTHIOPHENE,98%
4-Hexylthiophene
[EINECS(EC#)]

629-237-3
[Molecular Formula]

C10H16S
[MDL Number]

MFCD00143181
[Molecular Weight]

168.3
[MOL File]

1693-86-3.mol
Chemical PropertiesBack Directory
[Appearance]

colorless transparent or light yellow liquid
[Melting point ]

-39.15°C (estimate)
[Boiling point ]

65 °C/0.45 mmHg (lit.)
[density ]

0.936 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.496(lit.)
[Fp ]

100 °F
[storage temp. ]

Flammables area
[form ]

Liquid
[color ]

Clear colorless to slightly yellow or red
[Water Solubility ]

Partly soluble in water.
[Detection Methods]

GC,NMR
[BRN ]

1617129
[CAS DataBase Reference]

1693-86-3(CAS DataBase Reference)
Hazard InformationBack Directory
[Description]

3-Hexylthiophene?is the intermediate for the synthesis of poly(3-hexylthiophene), referred as P3HT. To date, it is the most studied polymer for polymer solar cells. The efficiency of a P3HT/PCBM solar cell is typically 4-5 %, but with new fullerene materials developed to closely match the energy levels of P3HT (HOMO 5.0 eV,?LUMO 3.0 eV), device performances have been pushed to 6.5% .
[Chemical Properties]

colorless transparent or light yellow liquid
[Uses]

3-n-Hexylthiophene is a conducting polymer precursor. may be used in the synthesis of poly(3-hexylthiophene). MgKR X-ray and low energy electron induced oligomerization of physisorbed layers of 3-hexylthiophene condensed on clean gold results in the formation of an organic film.
[Preparation]

The 2,5-dibromo-3-dodecylthiophene was dissolved in tetrahydromyran, added with methylmagnesium bromide, preheated and added with catalyst for reaction reaction was injected into alcohol solvent, and hexane was added to remove the copolymer, and then the mixture was soxhlet filtered using chloroform, and the chloroform layer was evaporated and concentrated to obtain a purple membrane; the purple membrane was vacuum filtered to obtain the product 3-hexylthiophene.
[General Description]

3-Hexylthiophene, a sulfur containing heterocyclic building block, is a thiophene derivative. Poly(3-hexylthiophene) (P3HT) nanofibres have been used for the preparation of organic phototransistors (OPTs).
Safety DataBack Directory
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R10:Flammable.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
R20:Harmful by inhalation.
[Safety Statements ]

S16:Keep away from sources of ignition-No smoking .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
[RIDADR ]

UN 1993 3/PG 3
[WGK Germany ]

3
[HazardClass ]

3
[PackingGroup ]

III
[HS Code ]

29349990
Spectrum DetailBack Directory
[Spectrum Detail]

3-Hexylthiophene(1693-86-3)MS
3-Hexylthiophene(1693-86-3)1HNMR
3-Hexylthiophene(1693-86-3)13CNMR
3-Hexylthiophene(1693-86-3)IR1
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-Hexylthiophene, 98%(1693-86-3)
[Sigma Aldrich]

1693-86-3(sigmaaldrich)
[TCI AMERICA]

3-Hexylthiophene,>98.0%(GC)(1693-86-3)
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