3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole

C36H22ClNO — CID 142753924

IUPAC3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole
SMILESClc1ccc2oc3c(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4-c4ccccc4)cccc3c2c1
InChIInChI=1S/C36H22ClNO/c37-25-18-20-35-31(22-25)29-14-8-13-27(36(29)39-35)24-17-19-34-30(21-24)28-12-5-7-16-33(28)38(34)32-15-6-4-11-26(32)23-9-2-1-3-10-23/h1-22H
InChIKeyWJHJOWNFRVYCMJ-UHFFFAOYSA-N
MW520.03 g/mol
LogP10.67
Rot. Bonds3

About 3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole

3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole (PubChem CID 142753924) has the molecular formula C36H22ClNO and a molecular weight of 520.03 g/mol. Its IUPAC name is 3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole.

Molecular Properties

Compound Name3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole
PubChem CID142753924
Molecular FormulaC36H22ClNO
Molecular Weight520.03 g/mol
Exact Mass519.14
IUPAC Name3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole
SMILESClc1ccc2oc3c(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4-c4ccccc4)cccc3c2c1
InChIInChI=1S/C36H22ClNO/c37-25-18-20-35-31(22-25)29-14-8-13-27(36(29)39-35)24-17-19-34-30(21-24)28-12-5-7-16-33(28)38(34)32-15-6-4-11-26(32)23-9-2-1-3-10-23/h1-22H
InChIKeyWJHJOWNFRVYCMJ-UHFFFAOYSA-N
XLogP10.67
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500520.03
LogP ≤ 510.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[6-(3-chlorophenyl)dibenzofuran-2-yl]-9-phenylcarbazole
CID 146820398
3-dibenzofuran-4-yl-9-(2-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 177209647
9-(8-chlorodibenzofuran-4-yl)carbazole
CID 139342225
9-phenyl-3-[3-(6-phenyldibenzofuran-2-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 122492344
3-(4-chlorophenyl)-9-[2-(4-phenylphenyl)phenyl]carbazole
CID 167454727
3-[9-dibenzofuran-4-yl-6-[3-[8-[3-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-9-yl]dibenzofuran-4-yl]phenyl]carbazol-3-yl]-6,9-diphenylcarbazole
CID 137420572
9-(2-dibenzofuran-4-ylphenyl)-3-(4-phenyldibenzofuran-3-yl)-6-(2-phenylphenyl)carbazole
CID 166011013
9-[3-(8-carbazol-9-yldibenzofuran-4-yl)phenyl]-3-dibenzofuran-4-ylcarbazole
CID 58099745
3-[8-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 137474197
3-(3-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole
CID 137466609
3-dibenzofuran-2-yl-9-(4-dibenzofuran-4-ylphenyl)carbazole
CID 121449395
9-[3-[8-[3-[3-(4-phenylphenyl)phenyl]phenyl]dibenzofuran-4-yl]phenyl]carbazole
CID 118438864

Frequently Asked Questions

What is the IUPAC name of 3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole?
The IUPAC name of 3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole (CID 142753924) is 3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole.
What is the SMILES notation for 3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole?
The canonical SMILES for 3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole is Clc1ccc2oc3c(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4-c4ccccc4)cccc3c2c1.
What is the InChIKey of 3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole?
The InChIKey is WJHJOWNFRVYCMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H22ClNO/c37-25-18-20-35-31(22-25)29-14-8-13-27(36(29)39-35)24-17-19-34-30(21-24)28-12-5-7-16-33(28)38(34)32-15-6-4-11-26(32)23-9-2-1-3-10-23/h1-22H.
What are the key properties of 3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole?
3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole has a molecular weight of 520.03 g/mol, XLogP of 10.67, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-chlorodibenzofuran-4-yl)-9-(2-phenylphenyl)carbazole is sourced from PubChem (CID 142753924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).