3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole

C188H184N8O5 — CID 158049920

About 3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole

3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole (PubChem CID 158049920) has the molecular formula C188H184N8O5 and a molecular weight of 2635.59 g/mol. Its IUPAC name is 3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole.

Molecular Properties

• Compound Name: 3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole
• PubChem CID: 158049920
• Molecular Formula: C188H184N8O5
• Molecular Weight: 2635.59 g/mol
• Exact Mass: 2633.44
• IUPAC Name: 3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole
• SMILES: CC(C)(C)OCCCc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.CC(C)OCCCc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.CCCCOCCCc1ccc2c(c1)c1cc(CCCOCCCC)ccc1n2-c1ccc(-c2ccc(-n3c4ccc(CCCC)cc4c4cc(CCCC)ccc43)cc2)cc1.CCCCOCCCc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2C)c(C)c1
• InChI: InChI=1S/C58H68N2O2.C45H42N2O.C43H38N2O.C42H36N2O/c1-5-9-15-43-19-31-55-51(39-43)52-40-44(16-10-6-2)20-32-56(52)59(55)49-27-23-47(24-28-49)48-25-29-50(30-26-48)60-57-33-21-45(17-13-37-61-35-11-7-3)41-53(57)54-42-46(22-34-58(54)60)18-14-38-62-36-12-8-4;1-4-5-26-48-27-12-13-33-20-25-45-41(30-33)40-16-8-11-19-44(40)47(45)35-22-24-37(32(3)29-35)36-23-21-34(28-31(36)2)46-42-17-9-6-14-38(42)39-15-7-10-18-43(39)46;1-43(2,3)46-28-10-11-30-18-27-42-38(29-30)37-14-6-9-17-41(37)45(42)34-25-21-32(22-26-34)31-19-23-33(24-20-31)44-39-15-7-4-12-35(39)36-13-5-8-16-40(36)44;1-29(2)45-27-9-10-30-17-26-42-38(28-30)37-13-5-8-16-41(37)44(42)34-24-20-32(21-25-34)31-18-22-33(23-19-31)43-39-14-6-3-11-35(39)36-12-4-7-15-40(36)43/h19-34,39-42H,5-18,35-38H2,1-4H3;6-11,14-25,28-30H,4-5,12-13,26-27H2,1-3H3;4-9,12-27,29H,10-11,28H2,1-3H3;3-8,11-26,28-29H,9-10,27H2,1-2H3
• InChIKey: FJIVCOXGNKVBHP-UHFFFAOYSA-N
• XLogP: 49.85
• TPSA: 85.59 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 48
• Heavy Atoms: 201
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2635.59
LogP ≤ 5	49.85
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole?

The IUPAC name of 3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole (CID 158049920) is 3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole.

What is the SMILES notation for 3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole?

The canonical SMILES for 3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole is CC(C)(C)OCCCc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.CC(C)OCCCc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.CCCCOCCCc1ccc2c(c1)c1cc(CCCOCCCC)ccc1n2-c1ccc(-c2ccc(-n3c4ccc(CCCC)cc4c4cc(CCCC)ccc43)cc2)cc1.CCCCOCCCc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2C)c(C)c1.

What is the InChIKey of 3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole?

The InChIKey is FJIVCOXGNKVBHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H68N2O2.C45H42N2O.C43H38N2O.C42H36N2O/c1-5-9-15-43-19-31-55-51(39-43)52-40-44(16-10-6-2)20-32-56(52)59(55)49-27-23-47(24-28-49)48-25-29-50(30-26-48)60-57-33-21-45(17-13-37-61-35-11-7-3)41-53(57)54-42-46(22-34-58(54)60)18-14-38-62-36-12-8-4;1-4-5-26-48-27-12-13-33-20-25-45-41(30-33)40-16-8-11-19-44(40)47(45)35-22-24-37(32(3)29-35)36-23-21-34(28-31(36)2)46-42-17-9-6-14-38(42)39-15-7-10-18-43(39)46;1-43(2,3)46-28-10-11-30-18-27-42-38(29-30)37-14-6-9-17-41(37)45(42)34-25-21-32(22-26-34)31-19-23-33(24-20-31)44-39-15-7-4-12-35(39)36-13-5-8-16-40(36)44;1-29(2)45-27-9-10-30-17-26-42-38(28-30)37-13-5-8-16-41(37)44(42)34-24-20-32(21-25-34)31-18-22-33(23-19-31)43-39-14-6-3-11-35(39)36-12-4-7-15-40(36)43/h19-34,39-42H,5-18,35-38H2,1-4H3;6-11,14-25,28-30H,4-5,12-13,26-27H2,1-3H3;4-9,12-27,29H,10-11,28H2,1-3H3;3-8,11-26,28-29H,9-10,27H2,1-2H3.

What are the key properties of 3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole?

3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole has a molecular weight of 2635.59 g/mol, XLogP of 49.85, 48 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 3,6-bis(3-butoxypropyl)-9-[4-[4-(3,6-dibutylcarbazol-9-yl)phenyl]phenyl]carbazole;3-(3-butoxypropyl)-9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-[3-[(2-methylpropan-2-yl)oxy]propyl]carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(3-propan-2-yloxypropyl)carbazole is sourced from PubChem (CID 158049920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).