Pentapheno[2,1,14,13,12,11-defghijkl]pyreno[2,1,10,9,8,7-pqrstuv]pentaphene

CAS Registry Number®

77968-44-6

CAS Name

Pentapheno[2,1,14,13,12,11-defghijkl]pyreno[2,1,10,9,8,7-pqrstuv]pentaphene

Molecular Formula

C42H16

Molecular Mass

520.58

Cite this Page

Pentapheno[2,1,14,13,12,11-defghijkl]pyreno[2,1,10,9,8,7-pqrstuv]pentaphene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=77968-44-6 (retrieved 2024-11-22) (CAS RN: 77968-44-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C42H16/c1-5-19-13-23-9-10-25-15-21-7-3-18-4-8-22-16-26-12-11-24-14-20-6-2-17(1)27-29(19)37-33(23)35(25)39-31(21)28(18)32(22)40-36(26)34(24)38(30(20)27)41(37)42(39)40/h1-16H

InChIKey

InChIKey=QYQKNXGEKCVVCL-UHFFFAOYSA-N

SMILES

C12=C3C=4C=5C=6C1=C7C=8C9=C2C=%10C=%11C3=C%12C=%13C4C%14=CC5C=CC6C=C7C=CC8C=CC9=CC%10C=CC%11C=C%12C=CC%13C=C%14

Canonical SMILES

C=1C=C2C=C3C=CC4=CC5=CC=C6C=CC7=CC8=CC=C9C=C%10C=CC1C=%11C2=C%12C3=C4C%13=C5C6=C7C=%14C8=C9C(C%10%11)=C%12C%13%14

Other Names for this Substance

  • Pentapheno[2,1,14,13,12,11-defghijkl]pyreno[2,1,10,9,8,7-pqrstuv]pentaphene
  • Circumpyrene

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