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α-Octithiophene

Catalog Number ACM113728715-1
CAS 113728-71-5
Structure α-Octithiophene
Synonyms 2-Thiophen-2-yl-5-[5-[5-[5-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophene
IUPAC Name 2-thiophen-2-yl-5-[5-[5-[5-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophene
Molecular Weight 659.00
Molecular Formula C32H18S8
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=C(S7)C8=CC=CS8
InChI InChI=1S/C32H18S8/c1-3-19(33-17-1)21-5-7-23(35-21)25-9-11-27(37-25)29-13-15-31(39-29)32-16-14-30(40-32)28-12-10-26(38-28)24-8-6-22(36-24)20-4-2-18-34-20/h1-18H
InChI Key GCMCTPRNKVKGCY-UHFFFAOYSA-N
Melting Point 364 °C
Purity 95%+
Appearance Powder or crystal
Storage Store under inert gas
Complexity 789
Covalently-Bonded Unit Count 1
Exact Mass 657.91742g/mol
Formal Charge 0
Heavy Atom Count 40
MDL Number MFCD00059956
Monoisotopic Mass 657.91742g/mol
Rotatable Bond Count 7

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