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[5]Cycloparaphenylene, 95%

Catalog Number
ACM96100946-1
CAS Number
96100-94-6
Product Name
[5]Cycloparaphenylene, 95%
Category
Carbon Nanomaterials
IUPAC Name
hexacyclo[16.2.2.22,5.26,9.210,13.214,17]triaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29-pentadecaene
Molecular Weight
380.5g/mol
Molecular Formula
C30H20
Canonical SMILES
C1=CC2=C3C=CC(=C4C=CC(=C5C=CC(=C6C=CC(=C1C=C2)C=C6)C=C5)C=C4)C=C3
InChI
InChI=1S/C30H20/c1-2-22-4-3-21(1)23-5-7-25(8-6-23)27-13-15-29(16-14-27)30-19-17-28(18-20-30)26-11-9-24(22)10-12-26/h1-20H
InChI Key
CPWZIBNNYXGKBU-UHFFFAOYSA-N
Complexity
906
Covalently-Bonded Unit Count
1
Exact Mass
380.156501g/mol
Formal Charge
0
Heavy Atom Count
30
Monoisotopic Mass
380.156501g/mol
Rotatable Bond Count
0
XLogP3
5.9
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