3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole

C36H24N2 — CID 20685483

IUPAC3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)ccc32)cc1
InChIInChI=1S/C36H24N2/c1-2-10-27(11-3-1)37-35-17-9-6-14-31(35)32-24-26(20-23-36(32)37)25-18-21-28(22-19-25)38-33-15-7-4-12-29(33)30-13-5-8-16-34(30)38/h1-24H
InChIKeyUFRMKJXURMUBOJ-UHFFFAOYSA-N
MW484.60 g/mol
LogP9.55
Rot. Bonds3

About 3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole

3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole (PubChem CID 20685483) has the molecular formula C36H24N2 and a molecular weight of 484.60 g/mol. Its IUPAC name is 3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole.

Molecular Properties

Compound Name3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole
PubChem CID20685483
Molecular FormulaC36H24N2
Molecular Weight484.60 g/mol
Exact Mass484.19
IUPAC Name3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)ccc32)cc1
InChIInChI=1S/C36H24N2/c1-2-10-27(11-3-1)37-35-17-9-6-14-31(35)32-24-26(20-23-36(32)37)25-18-21-28(22-19-25)38-33-15-7-4-12-29(33)30-13-5-8-16-34(30)38/h1-24H
InChIKeyUFRMKJXURMUBOJ-UHFFFAOYSA-N
XLogP9.55
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500484.60
LogP ≤ 59.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole?
The IUPAC name of 3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole (CID 20685483) is 3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole.
What is the SMILES notation for 3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole?
The canonical SMILES for 3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole is c1ccc(-n2c3ccccc3c3cc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)ccc32)cc1.
What is the InChIKey of 3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole?
The InChIKey is UFRMKJXURMUBOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H24N2/c1-2-10-27(11-3-1)37-35-17-9-6-14-31(35)32-24-26(20-23-36(32)37)25-18-21-28(22-19-25)38-33-15-7-4-12-29(33)30-13-5-8-16-34(30)38/h1-24H.
What are the key properties of 3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole?
3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole has a molecular weight of 484.60 g/mol, XLogP of 9.55, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole is sourced from PubChem (CID 20685483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).