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α-Septithiophene, ≥95%

Catalog Number
ACM86100632-2
Product Name
α-Septithiophene, ≥95%
Structure
CAS
86100-63-2
Category
Organic Light-Emitting Diode (OLED) Materials
IUPAC Name
2,5-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]thiophene
Molecular Weight
576.9g/mol
Molecular Formula
C28H16S7
Canonical SMILES
C1=CSC(=C1)C2=CC=C(S2)C3=CC=C(S3)C4=CC=C(S4)C5=CC=C(S5)C6=CC=C(S6)C7=CC=CS7
InChI
InChI=1S/C28H16S7/c1-3-17(29-15-1)19-5-7-21(31-19)23-9-11-25(33-23)27-13-14-28(35-27)26-12-10-24(34-26)22-8-6-20(32-22)18-4-2-16-30-18/h1-16H
InChI Key
DCIYLINCGGGNLC-UHFFFAOYSA-N
Complexity
661
Covalently-Bonded Unit Count
1
Exact Mass
575.929699g/mol
Formal Charge
0
Heavy Atom Count
35
Monoisotopic Mass
575.929699g/mol
Rotatable Bond Count
6
XLogP3
9.9
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