CAS 1222105-42-1 [7]Cycloparaphenylene - Materials / Alfa Chemistry

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[7]Cycloparaphenylene

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Catalog Number

ACM1222105421

CAS Number

1222105-42-1

Product Name

[7]Cycloparaphenylene

Category

Supramolecular Host Materials; Carbon Nanomaterials

IUPAC Name

octacyclo[24.2.2.22,5.26,9.210,13.214,17.218,21.222,25]dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosaene

Molecular Weight

532.7g/mol

Molecular Formula

C42H28

Canonical SMILES

C1=CC2=C3C=CC(=C4C=CC(=C5C=CC(=C6C=CC(=C7C=CC(=C8C=CC(=C1C=C2)C=C8)C=C7)C=C6)C=C5)C=C4)C=C3

InChI

InChI=1S/C42H28/c1-2-30-4-3-29(1)31-5-7-33(8-6-31)35-13-15-37(16-14-35)39-21-23-41(24-22-39)42-27-25-40(26-28-42)38-19-17-36(18-20-38)34-11-9-32(30)10-12-34/h1-28H

InChI Key

WGYDELDXZJCAJB-UHFFFAOYSA-N

Complexity

1340

Covalently-Bonded Unit Count

Exact Mass

532.219101g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

532.219101g/mol

Rotatable Bond Count

XLogP3

8.2

MSDS

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COA

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Spec Sheet

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