3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole

C91H60N2 — CID 154590571

About 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole

3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole (PubChem CID 154590571) has the molecular formula C91H60N2 and a molecular weight of 1181.49 g/mol. Its IUPAC name is 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole.

Molecular Properties

• Compound Name: 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole
• PubChem CID: 154590571
• Molecular Formula: C91H60N2
• Molecular Weight: 1181.49 g/mol
• Exact Mass: 1180.48
• IUPAC Name: 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole
• SMILES: c1ccc(-c2cccc(-c3ccccc3C3(c4cccc(-c5ccc(-c6ccc(-c7ccccc7-n7c8ccccc8c8cc(-c9ccc%10c(c9)c9ccccc9n%10-c9ccccc9-c9ccccc9)ccc87)cc6)cc5)c4)c4ccccc4-c4ccccc43)c2)cc1
• InChI: InChI=1S/C91H60N2/c1-3-23-61(24-4-1)67-27-21-29-71(57-67)73-31-7-14-38-82(73)91(83-39-15-8-34-76(83)77-35-9-16-40-84(77)91)72-30-22-28-68(58-72)64-47-45-62(46-48-64)63-49-51-66(52-50-63)75-33-11-18-42-86(75)93-88-44-20-13-37-79(88)81-60-70(54-56-90(81)93)69-53-55-89-80(59-69)78-36-12-19-43-87(78)92(89)85-41-17-10-32-74(85)65-25-5-2-6-26-65/h1-60H
• InChIKey: ZQXSSDVLYGTGLW-UHFFFAOYSA-N
• XLogP: 23.91
• TPSA: 9.86 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 11
• Heavy Atoms: 93
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1181.49
LogP ≤ 5	23.91
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole?

The IUPAC name of 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole (CID 154590571) is 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole.

What is the SMILES notation for 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole?

The canonical SMILES for 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole is c1ccc(-c2cccc(-c3ccccc3C3(c4cccc(-c5ccc(-c6ccc(-c7ccccc7-n7c8ccccc8c8cc(-c9ccc%10c(c9)c9ccccc9n%10-c9ccccc9-c9ccccc9)ccc87)cc6)cc5)c4)c4ccccc4-c4ccccc43)c2)cc1.

What is the InChIKey of 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole?

The InChIKey is ZQXSSDVLYGTGLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C91H60N2/c1-3-23-61(24-4-1)67-27-21-29-71(57-67)73-31-7-14-38-82(73)91(83-39-15-8-34-76(83)77-35-9-16-40-84(77)91)72-30-22-28-68(58-72)64-47-45-62(46-48-64)63-49-51-66(52-50-63)75-33-11-18-42-86(75)93-88-44-20-13-37-79(88)81-60-70(54-56-90(81)93)69-53-55-89-80(59-69)78-36-12-19-43-87(78)92(89)85-41-17-10-32-74(85)65-25-5-2-6-26-65/h1-60H.

What are the key properties of 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole?

3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole has a molecular weight of 1181.49 g/mol, XLogP of 23.91, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[9-[2-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole is sourced from PubChem (CID 154590571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).