Cas no 24330-18-5 (Decacyclo[58.3.1.14,8.111,15.118,22.125,29.132,36.139,43.146,50.153,57]doheptaconta-1(64),4,6,8(72),11,13,15(71),18,20,22(70),25,27,29(69),32,34,36(68),39,41,43(67),46,48,50(66),53,55,57(65),60,62-heptacosaene)

Decacyclo[58.3.1.14,8.111,15.118,22.125,29.132,36.139,43.146,50.153,57]doheptaconta-1(64),4,6,8(72),11,13,15(71),18,20,22(70),25,27,29(69),32,34,36(68),39,41,43(67),46,48,50(66),53,55,57(65),60,62-heptacosaene structure
24330-18-5 structure
Product Name:Decacyclo[58.3.1.14,8.111,15.118,22.125,29.132,36.139,43.146,50.153,57]doheptaconta-1(64),4,6,8(72),11,13,15(71),18,20,22(70),25,27,29(69),32,34,36(68),39,41,43(67),46,48,50(66),53,55,57(65),60,62-heptacosaene
CAS No:24330-18-5
MF:C72H72
MW:937.342100143433
CID:279768
PubChem ID:57357798
Update Time:2025-04-19

Decacyclo[58.3.1.14,8.111,15.118,22.125,29.132,36.139,43.146,50.153,57]doheptaconta-1(64),4,6,8(72),11,13,15(71),18,20,22(70),25,27,29(69),32,34,36(68),39,41,43(67),46,48,50(66),53,55,57(65),60,62-heptacosaene Chemical and Physical Properties

Names and Identifiers

    • Decacyclo[58.3.1.14,8.111,15.118,22.125,29.132,36.139,43.146,50.153,57]doheptaconta-1(64),4,6,8(72),11,13,15(71),18,20,22(70),25,27,29(69),32,34,36(68),39,41,43(67),46,48,50(66),53,55,57(65),60,62-heptacosaene
    • [29]Metacyclophane
    • Decacyclo[58.3.1.14,8.111,15.118,22.125,29.132,36.139,43.146,50.153,57]doheptaconta-1(64),4,6,8(72),11,13,15(71),18,20,22(70)
    • Decacyclo[58.3.1.14,8.111,15.118,22.125,29.132,36.139,43.146,50.153,57]doheptaconta-1(64),4,6,8(72),11,13,15(71),18,20,22(70),25,27,29(69),32,34,36(68),39,41,43(67),46,48,50(66),53,55,57(65),60,62-hep
    • Decacyclo[58.3.1.1~4,8~.1~11,15~.1~18,22~.1~25,29~.1~32,36~.1~39,43~.1~46,50~.1~53,57~]doheptaconta-1(64),4(72),5,7,11(71),12,14,18(70),19,21,25(69),26,28,32(68),33,35,39(67),40,42,46(66),47,49,53(65),54,56,60,62-heptacosaene
    • 24330-18-5
    • DTXSID60723864
    • Inchi： 1S/C72H72/c1-10-55-28-30-57-12-2-14-59(47-57)32-34-61-16-4-18-63(49-61)36-38-65-20-6-22-67(51-65)40-42-69-24-8-26-71(53-69)44-45-72-27-9-25-70(54-72)43-41-68-23-7-21-66(52-68)39-37-64-19-5-17-62(50-64)35-33-60-15-3-13-58(48-60)31-29-56(11-1)46-55/h1-27,46-54H,28-45H2
    • InChI Key： KIRYUPYIWKINFF-UHFFFAOYSA-N
    • SMILES： C1C2=CC=CC(=C2)CCC2=CC=CC(=C2)CCC2=CC=CC(=C2)CCC2=CC=CC(=C2)CCC2=CC=CC(=C2)CCC2=CC=CC(=C2)CCC2=CC=CC(=C2)CCC2=CC=CC(=C2)CCC2=CC=CC(=C2)C1

Computed Properties

  • Exact Mass: 936.56376
  • Monoisotopic Mass: 936.56340230g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 72
  • Rotatable Bond Count: 0
  • Complexity: 1030
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 19.9
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • PSA: 0

Decacyclo[58.3.1.14,8.111,15.118,22.125,29.132,36.139,43.146,50.153,57]doheptaconta-1(64),4,6,8(72),11,13,15(71),18,20,22(70),25,27,29(69),32,34,36(68),39,41,43(67),46,48,50(66),53,55,57(65),60,62-heptacosaene Related Literature

24330-18-5 (Decacyclo[58.3.1.14,8.111,15.118,22.125,29.132,36.139,43.146,50.153,57]doheptaconta-1(64),4,6,8(72),11,13,15(71),18,20,22(70),25,27,29(69),32,34,36(68),39,41,43(67),46,48,50(66),53,55,57(65),60,62-heptacosaene) Related Products

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