2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane

C126H92BClN4O2 — CID 157183824

About 2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane

2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane (PubChem CID 157183824) has the molecular formula C126H92BClN4O2 and a molecular weight of 1740.41 g/mol. Its IUPAC name is 2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane.

Molecular Properties

• Compound Name: 2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane
• PubChem CID: 157183824
• Molecular Formula: C126H92BClN4O2
• Molecular Weight: 1740.41 g/mol
• Exact Mass: 1738.70
• IUPAC Name: 2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane
• SMILES: CC1(C)OB(c2ccc(-c3cccc(-c4cccc(-c5ccccc5)c4)c3)cc2)OC1(C)C.Clc1cccc(-c2cccc(-n3c4ccccc4c4ccc(-n5c6ccccc6c6ccccc65)cc43)c2)c1.c1ccc(-c2cccc(-c3cccc(-c4ccc(-c5cccc(-c6cccc(-n7c8ccccc8c8ccc(-n9c%10ccccc%10c%10ccccc%109)cc87)c6)c5)cc4)c3)c2)cc1
• InChI: InChI=1S/C60H40N2.C36H23ClN2.C30H29BO2/c1-2-14-41(15-3-1)44-16-10-19-47(36-44)48-20-11-17-45(37-48)42-30-32-43(33-31-42)46-18-12-21-49(38-46)50-22-13-23-51(39-50)62-59-29-9-6-26-55(59)56-35-34-52(40-60(56)62)61-57-27-7-4-24-53(57)54-25-5-8-28-58(54)61;37-26-11-7-9-24(21-26)25-10-8-12-27(22-25)39-35-18-6-3-15-31(35)32-20-19-28(23-36(32)39)38-33-16-4-1-13-29(33)30-14-2-5-17-34(30)38;1-29(2)30(3,4)33-31(32-29)28-18-16-23(17-19-28)25-13-9-15-27(21-25)26-14-8-12-24(20-26)22-10-6-5-7-11-22/h1-40H;1-23H;5-21H,1-4H3
• InChIKey: AOWKIKYSRLDWME-UHFFFAOYSA-N
• XLogP: 33.40
• TPSA: 38.18 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 14
• Heavy Atoms: 134
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1740.41
LogP ≤ 5	33.40
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane?

The IUPAC name of 2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane (CID 157183824) is 2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane.

What is the SMILES notation for 2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane?

The canonical SMILES for 2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane is CC1(C)OB(c2ccc(-c3cccc(-c4cccc(-c5ccccc5)c4)c3)cc2)OC1(C)C.Clc1cccc(-c2cccc(-n3c4ccccc4c4ccc(-n5c6ccccc6c6ccccc65)cc43)c2)c1.c1ccc(-c2cccc(-c3cccc(-c4ccc(-c5cccc(-c6cccc(-n7c8ccccc8c8ccc(-n9c%10ccccc%10c%10ccccc%109)cc87)c6)c5)cc4)c3)c2)cc1.

What is the InChIKey of 2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane?

The InChIKey is AOWKIKYSRLDWME-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H40N2.C36H23ClN2.C30H29BO2/c1-2-14-41(15-3-1)44-16-10-19-47(36-44)48-20-11-17-45(37-48)42-30-32-43(33-31-42)46-18-12-21-49(38-46)50-22-13-23-51(39-50)62-59-29-9-6-26-55(59)56-35-34-52(40-60(56)62)61-57-27-7-4-24-53(57)54-25-5-8-28-58(54)61;37-26-11-7-9-24(21-26)25-10-8-12-27(22-25)39-35-18-6-3-15-31(35)32-20-19-28(23-36(32)39)38-33-16-4-1-13-29(33)30-14-2-5-17-34(30)38;1-29(2)30(3,4)33-31(32-29)28-18-16-23(17-19-28)25-13-9-15-27(21-25)26-14-8-12-24(20-26)22-10-6-5-7-11-22/h1-40H;1-23H;5-21H,1-4H3.

What are the key properties of 2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane?

2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane has a molecular weight of 1740.41 g/mol, XLogP of 33.40, 14 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-carbazol-9-yl-9-[3-(3-chlorophenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;4,4,5,5-tetramethyl-2-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,2-dioxaborolane is sourced from PubChem (CID 157183824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).