4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran

C40H26O — CID 170289932

IUPAC4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran
SMILESc1ccc(-c2ccc(-c3ccc4cc(-c5ccc(-c6cccc7c6oc6ccccc67)cc5)ccc4c3)cc2)cc1
InChIInChI=1S/C40H26O/c1-2-7-27(8-3-1)28-13-15-29(16-14-28)32-21-23-35-26-33(22-24-34(35)25-32)30-17-19-31(20-18-30)36-10-6-11-38-37-9-4-5-12-39(37)41-40(36)38/h1-26H
InChIKeyRTSLTZMFSYESAX-UHFFFAOYSA-N
MW522.65 g/mol
LogP11.41
Rot. Bonds4

About 4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran

4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran (PubChem CID 170289932) has the molecular formula C40H26O and a molecular weight of 522.65 g/mol. Its IUPAC name is 4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran.

Molecular Properties

Compound Name4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran
PubChem CID170289932
Molecular FormulaC40H26O
Molecular Weight522.65 g/mol
Exact Mass522.20
IUPAC Name4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran
SMILESc1ccc(-c2ccc(-c3ccc4cc(-c5ccc(-c6cccc7c6oc6ccccc67)cc5)ccc4c3)cc2)cc1
InChIInChI=1S/C40H26O/c1-2-7-27(8-3-1)28-13-15-29(16-14-28)32-21-23-35-26-33(22-24-34(35)25-32)30-17-19-31(20-18-30)36-10-6-11-38-37-9-4-5-12-39(37)41-40(36)38/h1-26H
InChIKeyRTSLTZMFSYESAX-UHFFFAOYSA-N
XLogP11.41
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500522.65
LogP ≤ 511.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-[4-[6-[4-(4-iodophenyl)phenyl]naphthalen-2-yl]phenyl]dibenzofuran
CID 170289926
4-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]dibenzofuran
CID 143811483
2-(4-dibenzofuran-4-ylphenyl)-4-(4-phenylphenyl)-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine
CID 168850178
N-(4-dibenzofuran-4-ylphenyl)-4-(3-naphthalen-2-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 155374400
N-(4-dibenzofuran-4-ylphenyl)-4-naphthalen-2-yl-N-[4-(6-phenyldibenzofuran-2-yl)phenyl]aniline
CID 168805171
4-[6-(6-phenylpyren-1-yl)naphthalen-2-yl]dibenzofuran
CID 58273738
N-(4-dibenzofuran-4-ylphenyl)-4-naphthalen-2-ylaniline
CID 155374295
2-dibenzofuran-4-yl-4-(3-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 155481453
N-dibenzofuran-4-yl-6-phenyl-N-(6-phenylnaphthalen-2-yl)dibenzofuran-4-amine
CID 167397315
3-N-(4-dibenzofuran-4-ylphenyl)-5-naphthalen-2-yl-1-N,1-N,3-N-tris(4-phenylphenyl)benzene-1,3-diamine
CID 162770461
2-dibenzofuran-4-yl-4-naphthalen-2-yl-6-(4-phenylphenyl)-1,3,5-triazine
CID 139441678
N-(4-dibenzofuran-4-ylphenyl)-N,3-bis(4-naphthalen-2-ylphenyl)aniline
CID 155374297

Frequently Asked Questions

What is the IUPAC name of 4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran?
The IUPAC name of 4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran (CID 170289932) is 4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran.
What is the SMILES notation for 4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran?
The canonical SMILES for 4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran is c1ccc(-c2ccc(-c3ccc4cc(-c5ccc(-c6cccc7c6oc6ccccc67)cc5)ccc4c3)cc2)cc1.
What is the InChIKey of 4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran?
The InChIKey is RTSLTZMFSYESAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H26O/c1-2-7-27(8-3-1)28-13-15-29(16-14-28)32-21-23-35-26-33(22-24-34(35)25-32)30-17-19-31(20-18-30)36-10-6-11-38-37-9-4-5-12-39(37)41-40(36)38/h1-26H.
What are the key properties of 4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran?
4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran has a molecular weight of 522.65 g/mol, XLogP of 11.41, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran is sourced from PubChem (CID 170289932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).