6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole

C42H27NO — CID 123910870

IUPAC6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole
SMILESc1ccc(-c2cc(-c3ccccc3)c3c(c2)c2cc(-c4cccc5c4oc4ccccc45)ccc2n3-c2ccccc2)cc1
InChIInChI=1S/C42H27NO/c1-4-13-28(14-5-1)31-26-36(29-15-6-2-7-16-29)41-38(27-31)37-25-30(23-24-39(37)43(41)32-17-8-3-9-18-32)33-20-12-21-35-34-19-10-11-22-40(34)44-42(33)35/h1-27H
InChIKeyBOOBLQYCITZHAM-UHFFFAOYSA-N
MW561.68 g/mol
LogP11.68
Rot. Bonds4

About 6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole

6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole (PubChem CID 123910870) has the molecular formula C42H27NO and a molecular weight of 561.68 g/mol. Its IUPAC name is 6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole.

Molecular Properties

Compound Name6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole
PubChem CID123910870
Molecular FormulaC42H27NO
Molecular Weight561.68 g/mol
Exact Mass561.21
IUPAC Name6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole
SMILESc1ccc(-c2cc(-c3ccccc3)c3c(c2)c2cc(-c4cccc5c4oc4ccccc45)ccc2n3-c2ccccc2)cc1
InChIInChI=1S/C42H27NO/c1-4-13-28(14-5-1)31-26-36(29-15-6-2-7-16-29)41-38(27-31)37-25-30(23-24-39(37)43(41)32-17-8-3-9-18-32)33-20-12-21-35-34-19-10-11-22-40(34)44-42(33)35/h1-27H
InChIKeyBOOBLQYCITZHAM-UHFFFAOYSA-N
XLogP11.68
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500561.68
LogP ≤ 511.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

12-(4-dibenzofuran-4-ylphenyl)-3,8,11-triphenylindolo[2,3-a]carbazole
CID 90191500
3-[3-[3-(4-dibenzofuran-4-ylphenyl)phenyl]phenyl]-9-phenylcarbazole
CID 121262432
1-[7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-6,9-diphenylcarbazole
CID 159616127
3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 134313296
3-dibenzofuran-4-yl-9-(3-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 121449361
3-dibenzofuran-4-yl-6,9-diphenylcarbazole;[6-(6,9-diphenylcarbazol-3-yl)dibenzofuran-4-yl]-trimethylsilane
CID 159059972
12-(4-dibenzofuran-4-ylphenyl)-5,9-diphenylindolo[3,2-c]carbazole
CID 126580189
9-phenyl-3-[3-(6-phenyldibenzofuran-2-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 122492344
3-dibenzofuran-4-yl-9-(9-phenylcarbazol-3-yl)carbazole
CID 170132775
3-bromo-6-dibenzofuran-4-yl-9-phenylcarbazole
CID 90089515
10-phenyl-8-(6-phenyldibenzofuran-4-yl)-[1]benzofuro[3,2-b]indole
CID 164828443
12-(4-carbazol-9-ylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-dibenzofuran-4-ylphenyl)-11-phenylindolo[2,3-a]carbazole;11,12-diphenyl-3-(9-phenylcarbazol-3-yl)indolo[2,3-a]carbazole;methane
CID 158881959

Frequently Asked Questions

What is the IUPAC name of 6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole?
The IUPAC name of 6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole (CID 123910870) is 6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole.
What is the SMILES notation for 6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole?
The canonical SMILES for 6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole is c1ccc(-c2cc(-c3ccccc3)c3c(c2)c2cc(-c4cccc5c4oc4ccccc45)ccc2n3-c2ccccc2)cc1.
What is the InChIKey of 6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole?
The InChIKey is BOOBLQYCITZHAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H27NO/c1-4-13-28(14-5-1)31-26-36(29-15-6-2-7-16-29)41-38(27-31)37-25-30(23-24-39(37)43(41)32-17-8-3-9-18-32)33-20-12-21-35-34-19-10-11-22-40(34)44-42(33)35/h1-27H.
What are the key properties of 6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole?
6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole has a molecular weight of 561.68 g/mol, XLogP of 11.68, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-dibenzofuran-4-yl-1,3,9-triphenylcarbazole is sourced from PubChem (CID 123910870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).