9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole

C204H123N5 — CID 162230175

About 9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole

9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole (PubChem CID 162230175) has the molecular formula C204H123N5 and a molecular weight of 2644.26 g/mol. Its IUPAC name is 9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole.

Molecular Properties

• Compound Name: 9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole
• PubChem CID: 162230175
• Molecular Formula: C204H123N5
• Molecular Weight: 2644.26 g/mol
• Exact Mass: 2641.98
• IUPAC Name: 9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole
• SMILES: c1ccc2c(c1)-c1cc3c4ccccc4c4ccccc4c3cc1-c1cc(-n3c4ccccc4c4ccccc43)ccc1-c1c-2cccc1-n1c2ccccc2c2ccccc21.c1ccc2c(c1)-c1cc3c4ccccc4c4ccccc4c3cc1-c1cccc(-n3c4ccccc4c4ccccc43)c1-c1ccccc1-2.c1ccc2c(c1)-c1cc3c4ccccc4c4ccccc4c3cc1-c1ccccc1-c1c-2cccc1-n1c2ccccc2c2ccccc21.c1ccc2c(c1)-c1ccc(-n3c4ccccc4c4ccccc43)cc1-c1ccccc1-c1cc3c4ccccc4c4ccccc4c3cc1-2
• InChI: InChI=1S/C60H36N2.3C48H29N/c1-4-19-41-38(16-1)39-17-2-5-20-42(39)52-36-54-50-34-37(61-55-27-11-7-22-44(55)45-23-8-12-28-56(45)61)32-33-49(50)60-48(40-18-3-6-21-43(40)53(54)35-51(41)52)26-15-31-59(60)62-57-29-13-9-24-46(57)47-25-10-14-30-58(47)62;1-4-18-34-30(14-1)31-15-2-5-19-35(31)42-29-44-40-24-13-27-47(49-45-25-11-9-21-37(45)38-22-10-12-26-46(38)49)48(40)39-23-8-7-17-33(39)32-16-3-6-20-36(32)43(44)28-41(34)42;1-4-17-33-30(14-1)31-15-2-5-18-34(31)42-29-44-36-20-7-8-23-39(36)48-40(32-16-3-6-19-35(32)43(44)28-41(33)42)24-13-27-47(48)49-45-25-11-9-21-37(45)38-22-10-12-26-46(38)49;1-4-16-34-31(13-1)32-14-2-5-17-35(32)44-29-46-38-20-8-7-19-37(38)42-27-30(49-47-23-11-9-21-40(47)41-22-10-12-24-48(41)49)25-26-39(42)33-15-3-6-18-36(33)45(46)28-43(34)44/h1-36H;3*1-29H/b48-40-,53-43-,54-50-,60-49+;33-32-,43-36-,44-40-,48-39+;40-32-,43-35-,44-36-,48-39+;39-33-,42-37-,45-36-,46-38-
• InChIKey: ZVHVLPIUPNYNPL-ZYRATOARSA-N
• XLogP: 56.00
• TPSA: 24.65 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 209
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2644.26
LogP ≤ 5	56.00
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole?

The IUPAC name of 9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole (CID 162230175) is 9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole.

What is the SMILES notation for 9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole?

The canonical SMILES for 9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole is c1ccc2c(c1)-c1cc3c4ccccc4c4ccccc4c3cc1-c1cc(-n3c4ccccc4c4ccccc43)ccc1-c1c-2cccc1-n1c2ccccc2c2ccccc21.c1ccc2c(c1)-c1cc3c4ccccc4c4ccccc4c3cc1-c1cccc(-n3c4ccccc4c4ccccc43)c1-c1ccccc1-2.c1ccc2c(c1)-c1cc3c4ccccc4c4ccccc4c3cc1-c1ccccc1-c1c-2cccc1-n1c2ccccc2c2ccccc21.c1ccc2c(c1)-c1ccc(-n3c4ccccc4c4ccccc43)cc1-c1ccccc1-c1cc3c4ccccc4c4ccccc4c3cc1-2.

What is the InChIKey of 9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole?

The InChIKey is ZVHVLPIUPNYNPL-ZYRATOARSA-N. The full InChI is InChI=1S/C60H36N2.3C48H29N/c1-4-19-41-38(16-1)39-17-2-5-20-42(39)52-36-54-50-34-37(61-55-27-11-7-22-44(55)45-23-8-12-28-56(45)61)32-33-49(50)60-48(40-18-3-6-21-43(40)53(54)35-51(41)52)26-15-31-59(60)62-57-29-13-9-24-46(57)47-25-10-14-30-58(47)62;1-4-18-34-30(14-1)31-15-2-5-19-35(31)42-29-44-40-24-13-27-47(49-45-25-11-9-21-37(45)38-22-10-12-26-46(38)49)48(40)39-23-8-7-17-33(39)32-16-3-6-20-36(32)43(44)28-41(34)42;1-4-17-33-30(14-1)31-15-2-5-18-34(31)42-29-44-36-20-7-8-23-39(36)48-40(32-16-3-6-19-35(32)43(44)28-41(33)42)24-13-27-47(48)49-45-25-11-9-21-37(45)38-22-10-12-26-46(38)49;1-4-16-34-31(13-1)32-14-2-5-17-35(32)44-29-46-38-20-8-7-19-37(38)42-27-30(49-47-23-11-9-21-40(47)41-22-10-12-24-48(41)49)25-26-39(42)33-15-3-6-18-36(33)45(46)28-43(34)44/h1-36H;3*1-29H/b48-40-,53-43-,54-50-,60-49+;33-32-,43-36-,44-40-,48-39+;40-32-,43-35-,44-36-,48-39+;39-33-,42-37-,45-36-,46-38-.

What are the key properties of 9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole?

9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole has a molecular weight of 2644.26 g/mol, XLogP of 56.00, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole is sourced from PubChem (CID 162230175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).