4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran

C43H28O — CID 66686164

IUPAC4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran
SMILESc1ccc(-c2cccc3c2oc2c(-c4cccc(C5(c6ccccc6)c6ccccc6-c6ccccc65)c4)cccc23)cc1
InChIInChI=1S/C43H28O/c1-3-14-29(15-4-1)33-22-12-24-37-38-25-13-23-34(42(38)44-41(33)37)30-16-11-19-32(28-30)43(31-17-5-2-6-18-31)39-26-9-7-20-35(39)36-21-8-10-27-40(36)43/h1-28H
InChIKeyQZMZUXKZQLDKSA-UHFFFAOYSA-N
MW560.70 g/mol
LogP11.28
Rot. Bonds4

About 4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran

4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran (PubChem CID 66686164) has the molecular formula C43H28O and a molecular weight of 560.70 g/mol. Its IUPAC name is 4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran.

Molecular Properties

Compound Name4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran
PubChem CID66686164
Molecular FormulaC43H28O
Molecular Weight560.70 g/mol
Exact Mass560.21
IUPAC Name4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran
SMILESc1ccc(-c2cccc3c2oc2c(-c4cccc(C5(c6ccccc6)c6ccccc6-c6ccccc65)c4)cccc23)cc1
InChIInChI=1S/C43H28O/c1-3-14-29(15-4-1)33-22-12-24-37-38-25-13-23-34(42(38)44-41(33)37)30-16-11-19-32(28-30)43(31-17-5-2-6-18-31)39-26-9-7-20-35(39)36-21-8-10-27-40(36)43/h1-28H
InChIKeyQZMZUXKZQLDKSA-UHFFFAOYSA-N
XLogP11.28
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500560.70
LogP ≤ 511.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-phenyl-6-[2-(9-phenylfluoren-9-yl)phenyl]dibenzofuran;4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran;4-phenyl-6-[4-(9-phenylfluoren-9-yl)phenyl]dibenzofuran
CID 159547141
4-phenyl-N-[4-[6-[4-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-4-yl]phenyl]-N-(4-phenylphenyl)aniline
CID 164724700
2-(6,8-diphenyldibenzofuran-4-yl)-4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]-1,3,5-triazine
CID 174361627
4-(7-dibenzofuran-4-yl-9,9-diphenylfluoren-2-yl)dibenzofuran
CID 135131477
2-[3-(9-phenylfluoren-9-yl)phenyl]triphenylene
CID 123153262
4-(2-dibenzofuran-4-ylphenyl)-2-phenyl-6-[2-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]pyrimidine
CID 171603080
4-[6-[4-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-4-yl]-N,N-bis(4-phenylphenyl)naphthalen-1-amine
CID 164724674
N-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine
CID 138669005
9,9-dimethyl-N-[4-[6-[4-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-4-yl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 164724626
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 121381438
9,9-bis[3-(3-phenylphenyl)phenyl]fluorene
CID 140873482
4-[3-[9-(3-dibenzofuran-4-ylphenyl)fluoren-9-yl]phenyl]dibenzofuran;4-[4-[9-(4-dibenzofuran-4-ylphenyl)fluoren-9-yl]phenyl]dibenzofuran;4-[3-[9-[3-(2,8-diphenyldibenzothiophen-4-yl)phenyl]fluoren-9-yl]phenyl]-2,8-diphenyldibenzothiophene
CID 159271691

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran?
The IUPAC name of 4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran (CID 66686164) is 4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran.
What is the SMILES notation for 4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran?
The canonical SMILES for 4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran is c1ccc(-c2cccc3c2oc2c(-c4cccc(C5(c6ccccc6)c6ccccc6-c6ccccc65)c4)cccc23)cc1.
What is the InChIKey of 4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran?
The InChIKey is QZMZUXKZQLDKSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H28O/c1-3-14-29(15-4-1)33-22-12-24-37-38-25-13-23-34(42(38)44-41(33)37)30-16-11-19-32(28-30)43(31-17-5-2-6-18-31)39-26-9-7-20-35(39)36-21-8-10-27-40(36)43/h1-28H.
What are the key properties of 4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran?
4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran has a molecular weight of 560.70 g/mol, XLogP of 11.28, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran is sourced from PubChem (CID 66686164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).