3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole

C36H22BrNO — CID 118462672

IUPAC3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole
SMILESBrc1ccccc1-c1cccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccccc4c3c2)c1
InChIInChI=1S/C36H22BrNO/c37-32-13-4-1-10-27(32)25-9-7-8-23(20-25)24-16-18-34-30(21-24)28-11-2-5-14-33(28)38(34)26-17-19-36-31(22-26)29-12-3-6-15-35(29)39-36/h1-22H
InChIKeyJOOPHQPUUDGFDO-UHFFFAOYSA-N
MW564.48 g/mol
LogP10.78
Rot. Bonds3

About 3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole

3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole (PubChem CID 118462672) has the molecular formula C36H22BrNO and a molecular weight of 564.48 g/mol. Its IUPAC name is 3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole.

Molecular Properties

Compound Name3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole
PubChem CID118462672
Molecular FormulaC36H22BrNO
Molecular Weight564.48 g/mol
Exact Mass563.09
IUPAC Name3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole
SMILESBrc1ccccc1-c1cccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccccc4c3c2)c1
InChIInChI=1S/C36H22BrNO/c37-32-13-4-1-10-27(32)25-9-7-8-23(20-25)24-16-18-34-30(21-24)28-11-2-5-14-33(28)38(34)26-17-19-36-31(22-26)29-12-3-6-15-35(29)39-36/h1-22H
InChIKeyJOOPHQPUUDGFDO-UHFFFAOYSA-N
XLogP10.78
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500564.48
LogP ≤ 510.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-dibenzofuran-2-yl-3-[3-(3-dibenzofuran-2-ylphenyl)phenyl]carbazole
CID 123818422
9-dibenzofuran-2-yl-3-[3-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]phenyl]carbazole
CID 123613126
3-[3-(3-dibenzofuran-2-ylphenyl)carbazol-9-yl]-9-[8-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]carbazole
CID 123419299
9-dibenzofuran-2-yl-3-phenyl-6-(3-phenylphenyl)carbazole
CID 118488369
9-[8-[8-(8-carbazol-9-yldibenzofuran-2-yl)dibenzofuran-2-yl]dibenzofuran-2-yl]carbazole;9-[8-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]dibenzofuran-2-yl]carbazole
CID 158645763
3-carbazol-9-yl-9-[8-[3-[3-(3-phenylphenyl)phenyl]phenyl]dibenzofuran-2-yl]carbazole;2-dibenzofuran-2-yl-9-[8-[3-(3-phenylphenyl)phenyl]dibenzofuran-2-yl]carbazole;9-[8-[3-(3-phenylphenyl)phenyl]dibenzofuran-2-yl]carbazole;3-phenyl-9-[8-[3-[3-(3-phenylphenyl)phenyl]phenyl]dibenzofuran-2-yl]carbazole;3-phenyl-9-[9-[8-[3-[3-(3-phenylphenyl)phenyl]phenyl]dibenzofuran-2-yl]carbazol-3-yl]carbazole
CID 159735182
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-[3-(3,5-diphenylphenyl)phenyl]-6-phenylcarbazole
CID 129265423
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole
CID 90350922
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-6-phenyl-9-(3-phenylphenyl)carbazole
CID 170072680
3-phenyl-9-[8-[3-phenyl-5-(3-phenylphenyl)phenyl]dibenzofuran-2-yl]carbazole
CID 170390017
3-carbazol-9-yl-6-[8-[3-[8-(6-carbazol-9-yl-9-phenylcarbazol-3-yl)dibenzofuran-2-yl]phenyl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 148847912
benzene;9-[8-(3-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]carbazole;ethene
CID 144788060

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole?
The IUPAC name of 3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole (CID 118462672) is 3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole.
What is the SMILES notation for 3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole?
The canonical SMILES for 3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole is Brc1ccccc1-c1cccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4ccccc4c3c2)c1.
What is the InChIKey of 3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole?
The InChIKey is JOOPHQPUUDGFDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H22BrNO/c37-32-13-4-1-10-27(32)25-9-7-8-23(20-25)24-16-18-34-30(21-24)28-11-2-5-14-33(28)38(34)26-17-19-36-31(22-26)29-12-3-6-15-35(29)39-36/h1-22H.
What are the key properties of 3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole?
3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole has a molecular weight of 564.48 g/mol, XLogP of 10.78, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-bromophenyl)phenyl]-9-dibenzofuran-2-ylcarbazole is sourced from PubChem (CID 118462672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).