9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole

C66H43NO — CID 166010977

IUPAC9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole
SMILESc1ccc(-c2ccccc2-c2cc3c4cc(-c5ccccc5-c5ccccc5)c(-c5ccccc5)cc4n(-c4ccccc4-c4cccc5c4oc4ccccc45)c3cc2-c2ccccc2)cc1
InChIInChI=1S/C66H43NO/c1-5-22-44(23-6-1)48-30-13-15-32-50(48)58-40-60-61-41-59(51-33-16-14-31-49(51)45-24-7-2-8-25-45)57(47-28-11-4-12-29-47)43-64(61)67(63(60)42-56(58)46-26-9-3-10-27-46)62-38-19-17-34-52(62)54-36-21-37-55-53-35-18-20-39-65(53)68-66(54)55/h1-43H
InChIKeyXWHWPTSSEFRRHX-UHFFFAOYSA-N
MW866.08 g/mol
LogP18.35
Rot. Bonds8

About 9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole

9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole (PubChem CID 166010977) has the molecular formula C66H43NO and a molecular weight of 866.08 g/mol. Its IUPAC name is 9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole.

Molecular Properties

Compound Name9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole
PubChem CID166010977
Molecular FormulaC66H43NO
Molecular Weight866.08 g/mol
Exact Mass865.33
IUPAC Name9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole
SMILESc1ccc(-c2ccccc2-c2cc3c4cc(-c5ccccc5-c5ccccc5)c(-c5ccccc5)cc4n(-c4ccccc4-c4cccc5c4oc4ccccc45)c3cc2-c2ccccc2)cc1
InChIInChI=1S/C66H43NO/c1-5-22-44(23-6-1)48-30-13-15-32-50(48)58-40-60-61-41-59(51-33-16-14-31-49(51)45-24-7-2-8-25-45)57(47-28-11-4-12-29-47)43-64(61)67(63(60)42-56(58)46-26-9-3-10-27-46)62-38-19-17-34-52(62)54-36-21-37-55-53-35-18-20-39-65(53)68-66(54)55/h1-43H
InChIKeyXWHWPTSSEFRRHX-UHFFFAOYSA-N
XLogP18.35
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500866.08
LogP ≤ 518.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-(2-dibenzofuran-4-ylphenyl)-3-(4-phenyldibenzofuran-3-yl)-6-(2-phenylphenyl)carbazole
CID 166011013
9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole
CID 90348741
N-[2-(2-carbazol-9-ylphenyl)phenyl]-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-2-phenylaniline
CID 139544518
3,6-dibromo-9-(2-dibenzofuran-4-ylphenyl)carbazole
CID 169284938
9-dibenzofuran-4-yl-3-phenyl-2-(9-phenylcarbazol-2-yl)carbazole
CID 90321642
3-dibenzofuran-4-yl-9-(2-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 177209647
N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]triphenylen-2-amine
CID 139544867
2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline
CID 139544521
9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole
CID 118149283
N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(3-dibenzofuran-4-ylphenyl)-2-phenylaniline
CID 139544776
9-dibenzofuran-4-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole
CID 90348740
9-(9-dibenzofuran-4-yl-6-phenyldibenzofuran-4-yl)carbazole
CID 147826287

Frequently Asked Questions

What is the IUPAC name of 9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole?
The IUPAC name of 9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole (CID 166010977) is 9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole.
What is the SMILES notation for 9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole?
The canonical SMILES for 9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole is c1ccc(-c2ccccc2-c2cc3c4cc(-c5ccccc5-c5ccccc5)c(-c5ccccc5)cc4n(-c4ccccc4-c4cccc5c4oc4ccccc45)c3cc2-c2ccccc2)cc1.
What is the InChIKey of 9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole?
The InChIKey is XWHWPTSSEFRRHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H43NO/c1-5-22-44(23-6-1)48-30-13-15-32-50(48)58-40-60-61-41-59(51-33-16-14-31-49(51)45-24-7-2-8-25-45)57(47-28-11-4-12-29-47)43-64(61)67(63(60)42-56(58)46-26-9-3-10-27-46)62-38-19-17-34-52(62)54-36-21-37-55-53-35-18-20-39-65(53)68-66(54)55/h1-43H.
What are the key properties of 9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole?
9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole has a molecular weight of 866.08 g/mol, XLogP of 18.35, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole is sourced from PubChem (CID 166010977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).