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[8]Cycloparaphenylene, 95%

Catalog Number
ACM1217269856-1
Product Name
[8]Cycloparaphenylene, 95%
CAS
1217269-85-6
Category
Carbon Nanomaterials
IUPAC Name
nonacyclo[28.2.2.22,5.26,9.210,13.214,17.218,21.222,25.226,29]octatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47-tetracosaene
Molecular Weight
608.8g/mol
Molecular Formula
C48H32
Canonical SMILES
C1=CC2=C3C=CC(=C4C=CC(=C5C=CC(=C6C=CC(=C7C=CC(=C8C=CC(=C9C=CC(=C1C=C2)C=C9)C=C8)C=C7)C=C6)C=C5)C=C4)C=C3
InChI
InChI=1S/C48H32/c1-2-34-4-3-33(1)35-5-7-37(8-6-35)39-13-15-41(16-14-39)43-21-23-45(24-22-43)47-29-31-48(32-30-47)46-27-25-44(26-28-46)42-19-17-40(18-20-42)38-11-9-36(34)10-12-38/h1-32H
InChI Key
KOSJMHFAWQDZFH-UHFFFAOYSA-N
Complexity
1560
Covalently-Bonded Unit Count
1
Exact Mass
608.250401g/mol
Formal Charge
0
Heavy Atom Count
48
Monoisotopic Mass
608.250401g/mol
Rotatable Bond Count
0
XLogP3
9.4
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