5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene

C384H244N2OS2 — CID 158568442

About 5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene

5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene (PubChem CID 158568442) has the molecular formula C384H244N2OS2 and a molecular weight of 4966.32 g/mol. Its IUPAC name is 5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene.

Molecular Properties

• Compound Name: 5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene
• PubChem CID: 158568442
• Molecular Formula: C384H244N2OS2
• Molecular Weight: 4966.32 g/mol
• Exact Mass: 4961.85
• IUPAC Name: 5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene
• SMILES: CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4ccc5ccc6c(-c7cccc(-c8ccc9c(c8)C(C)(C)c8ccccc8-9)c7)cc7c8ccccc8ccc7c6c5c4)c3)cc21.c1ccc(-c2cc3ccc4cc(-c5ccccc5)c5ccccc5c4c3c3ccccc23)cc1.c1ccc(-c2ccc3ccc4ccc5c6ccccc6ccc5c4c3c2)c(-c2ccc3sc4ccccc4c3c2)c1.c1ccc(-c2cccc(-c3cc4ccc5c6ccccc6ccc5c4c4ccccc34)c2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5ccc6ccc7c8ccccc8ccc7c6c5c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3ccc(-c4cc5ccc6c7ccccc7ccc6c5c5ccccc45)cc32)cc1.c1ccc2c(c1)ccc1c2ccc2c(-c3ccc4oc5ccccc5c4c3)cc3ccccc3c21.c1ccc2c(c1)ccc1c2ccc2c(-c3ccc4sc5ccccc5c4c3)cc3ccccc3c21.c1ccc2cc(-c3cc4ccc5ccc6ccccc6c5c4c4ccccc34)ccc2c1.c1ccc2cc(-c3ccc4ccc5ccc6c7ccccc7ccc6c5c4c3)ccc2c1
• InChI: InChI=1S/C64H46.2C40H25N.C40H24S.C34H20O.C34H20S.2C34H22.2C32H20/c1-63(2)58-21-9-7-19-49(58)51-29-27-45(36-60(51)63)42-15-11-14-41(33-42)44-24-23-40-26-31-53-55(38-57-48-18-6-5-13-39(48)25-32-54(57)62(53)56(40)35-44)47-17-12-16-43(34-47)46-28-30-52-50-20-8-10-22-59(50)64(3,4)61(52)37-46;1-2-11-29(12-3-1)41-38-17-9-8-15-33(38)34-22-19-27(25-39(34)41)37-24-28-20-21-32-30-13-5-4-10-26(30)18-23-36(32)40(28)35-16-7-6-14-31(35)37;1-2-9-31(10-3-1)41-38-13-7-6-12-34(38)37-25-30(20-23-39(37)41)29-17-15-27-14-16-28-19-21-33-32-11-5-4-8-26(32)18-22-35(33)40(28)36(27)24-29;1-2-8-30-25(7-1)17-21-35-33(30)20-18-27-15-13-26-14-16-28(23-36(26)40(27)35)31-9-3-4-10-32(31)29-19-22-39-37(24-29)34-11-5-6-12-38(34)41-39;2*1-3-9-24-21(7-1)13-15-28-26(24)16-17-29-30(19-22-8-2-4-10-25(22)34(28)29)23-14-18-33-31(20-23)27-11-5-6-12-32(27)35-33;1-3-11-23(12-4-1)31-21-25-19-20-26-22-32(24-13-5-2-6-14-24)28-16-8-10-18-30(28)34(26)33(25)29-17-9-7-15-27(29)31;1-2-9-23(10-3-1)25-12-8-13-26(21-25)33-22-27-18-19-30-28-14-5-4-11-24(28)17-20-32(30)34(27)31-16-7-6-15-29(31)33;1-2-9-24-19-25(17-13-21(24)7-1)30-20-26-18-16-23-15-14-22-8-3-4-10-27(22)31(23)32(26)29-12-6-5-11-28(29)30;1-2-7-25-19-26(13-9-21(25)5-1)27-14-11-23-10-12-24-16-17-29-28-8-4-3-6-22(28)15-18-30(29)32(24)31(23)20-27/h5-38H,1-4H3;2*1-25H;1-24H;2*1-20H;2*1-22H;2*1-20H
• InChIKey: HRTVMYUTSYXMLP-UHFFFAOYSA-N
• XLogP: 109.41
• TPSA: 23.00 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 18
• Heavy Atoms: 389
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	4966.32
LogP ≤ 5	109.41
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene?

The IUPAC name of 5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene (CID 158568442) is 5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene.

What is the SMILES notation for 5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene?

The canonical SMILES for 5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene is CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4ccc5ccc6c(-c7cccc(-c8ccc9c(c8)C(C)(C)c8ccccc8-9)c7)cc7c8ccccc8ccc7c6c5c4)c3)cc21.c1ccc(-c2cc3ccc4cc(-c5ccccc5)c5ccccc5c4c3c3ccccc23)cc1.c1ccc(-c2ccc3ccc4ccc5c6ccccc6ccc5c4c3c2)c(-c2ccc3sc4ccccc4c3c2)c1.c1ccc(-c2cccc(-c3cc4ccc5c6ccccc6ccc5c4c4ccccc34)c2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5ccc6ccc7c8ccccc8ccc7c6c5c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3ccc(-c4cc5ccc6c7ccccc7ccc6c5c5ccccc45)cc32)cc1.c1ccc2c(c1)ccc1c2ccc2c(-c3ccc4oc5ccccc5c4c3)cc3ccccc3c21.c1ccc2c(c1)ccc1c2ccc2c(-c3ccc4sc5ccccc5c4c3)cc3ccccc3c21.c1ccc2cc(-c3cc4ccc5ccc6ccccc6c5c4c4ccccc34)ccc2c1.c1ccc2cc(-c3ccc4ccc5ccc6c7ccccc7ccc6c5c4c3)ccc2c1.

What is the InChIKey of 5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene?

The InChIKey is HRTVMYUTSYXMLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H46.2C40H25N.C40H24S.C34H20O.C34H20S.2C34H22.2C32H20/c1-63(2)58-21-9-7-19-49(58)51-29-27-45(36-60(51)63)42-15-11-14-41(33-42)44-24-23-40-26-31-53-55(38-57-48-18-6-5-13-39(48)25-32-54(57)62(53)56(40)35-44)47-17-12-16-43(34-47)46-28-30-52-50-20-8-10-22-59(50)64(3,4)61(52)37-46;1-2-11-29(12-3-1)41-38-17-9-8-15-33(38)34-22-19-27(25-39(34)41)37-24-28-20-21-32-30-13-5-4-10-26(30)18-23-36(32)40(28)35-16-7-6-14-31(35)37;1-2-9-31(10-3-1)41-38-13-7-6-12-34(38)37-25-30(20-23-39(37)41)29-17-15-27-14-16-28-19-21-33-32-11-5-4-8-26(32)18-22-35(33)40(28)36(27)24-29;1-2-8-30-25(7-1)17-21-35-33(30)20-18-27-15-13-26-14-16-28(23-36(26)40(27)35)31-9-3-4-10-32(31)29-19-22-39-37(24-29)34-11-5-6-12-38(34)41-39;2*1-3-9-24-21(7-1)13-15-28-26(24)16-17-29-30(19-22-8-2-4-10-25(22)34(28)29)23-14-18-33-31(20-23)27-11-5-6-12-32(27)35-33;1-3-11-23(12-4-1)31-21-25-19-20-26-22-32(24-13-5-2-6-14-24)28-16-8-10-18-30(28)34(26)33(25)29-17-9-7-15-27(29)31;1-2-9-23(10-3-1)25-12-8-13-26(21-25)33-22-27-18-19-30-28-14-5-4-11-24(28)17-20-32(30)34(27)31-16-7-6-15-29(31)33;1-2-9-24-19-25(17-13-21(24)7-1)30-20-26-18-16-23-15-14-22-8-3-4-10-27(22)31(23)32(26)29-12-6-5-11-28(29)30;1-2-7-25-19-26(13-9-21(25)5-1)27-14-11-23-10-12-24-16-17-29-28-8-4-3-6-22(28)15-18-30(29)32(24)31(23)20-27/h5-38H,1-4H3;2*1-25H;1-24H;2*1-20H;2*1-22H;2*1-20H.

What are the key properties of 5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene?

5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene has a molecular weight of 4966.32 g/mol, XLogP of 109.41, 18 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 5,12-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1,3(8),4,6,9,11,13,15,17,19,21-undecaene;9,16-diphenylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;5-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaene;9-naphthalen-2-ylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzofuran;2-(10-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)dibenzothiophene;2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;3-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole;2-[2-(5-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene;9-(3-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene is sourced from PubChem (CID 158568442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).