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3-(2-Ethyl-hexyl)-thiophene

Catalog Number
ACM121134381-1
CAS Number
121134-38-1
Product Name
3-(2-Ethyl-hexyl)-thiophene
Structure
Category
Organic Light-Emitting Diode (OLED) Materials
IUPAC Name
3-(2-ethylhexyl)thiophene
Molecular Weight
196.35g/mol
Molecular Formula
C12H20S
Canonical SMILES
CCCCC(CC)CC1=CSC=C1
InChI
InChI=1S/C12H20S/c1-3-5-6-11(4-2)9-12-7-8-13-10-12/h7-8,10-11H,3-6,9H2,1-2H3
InChI Key
HWMQCIZYXLAJKM-UHFFFAOYSA-N
Complexity
122
Covalently-Bonded Unit Count
1
Exact Mass
196.128572g/mol
Formal Charge
0
Heavy Atom Count
13
Monoisotopic Mass
196.128572g/mol
Rotatable Bond Count
6
XLogP3
5.4
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