CAS 156980-13-1 [6]Cycloparaphenylene - Materials / Alfa Chemistry

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[6]Cycloparaphenylene

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Catalog Number

ACM156980131

Product Name

[6]Cycloparaphenylene

CAS

156980-13-1

Category

Supramolecular Host Materials

IUPAC Name

heptacyclo[20.2.2.22,5.26,9.210,13.214,17.218,21]hexatriaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35-octadecaene

Molecular Weight

456.6g/mol

Molecular Formula

C36H24

Canonical SMILES

C1=CC2=C3C=CC(=C4C=CC(=C5C=CC(=C6C=CC(=C7C=CC(=C1C=C2)C=C7)C=C6)C=C5)C=C4)C=C3

InChI

InChI=1S/C36H24/c1-2-26-4-3-25(1)27-5-7-29(8-6-27)31-13-15-33(16-14-31)35-21-23-36(24-22-35)34-19-17-32(18-20-34)30-11-9-28(26)10-12-30/h1-24H

InChI Key

HNGGBZMJWQRDDA-UHFFFAOYSA-N

Complexity

1120

Covalently-Bonded Unit Count

Exact Mass

456.187801g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

456.187801g/mol

Rotatable Bond Count

XLogP3

MSDS

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COA

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Spec Sheet

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