2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran

C30H19FO — CID 171056558

IUPAC2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran
SMILESFc1cccc(-c2ccc(-c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)cc2)c1
InChIInChI=1S/C30H19FO/c31-26-5-3-4-24(18-26)22-12-8-20(9-13-22)21-10-14-23(15-11-21)25-16-17-30-28(19-25)27-6-1-2-7-29(27)32-30/h1-19H
InChIKeyJQDWFDGOPIKHMY-UHFFFAOYSA-N
MW414.48 g/mol
LogP8.73
Rot. Bonds3

About 2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran

2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran (PubChem CID 171056558) has the molecular formula C30H19FO and a molecular weight of 414.48 g/mol. Its IUPAC name is 2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran.

Molecular Properties

Compound Name2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran
PubChem CID171056558
Molecular FormulaC30H19FO
Molecular Weight414.48 g/mol
Exact Mass414.14
IUPAC Name2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran
SMILESFc1cccc(-c2ccc(-c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)cc2)c1
InChIInChI=1S/C30H19FO/c31-26-5-3-4-24(18-26)22-12-8-20(9-13-22)21-10-14-23(15-11-21)25-16-17-30-28(19-25)27-6-1-2-7-29(27)32-30/h1-19H
InChIKeyJQDWFDGOPIKHMY-UHFFFAOYSA-N
XLogP8.73
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.48
LogP ≤ 58.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[4-[6-(4-fluorophenyl)naphthalen-2-yl]phenyl]dibenzofuran
CID 169293505
3-dibenzofuran-2-yl-N,N-bis[3-(3,5-difluorophenyl)phenyl]aniline
CID 171750067
6-[3-(3-triphenylen-2-ylphenyl)phenyl]-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaene
CID 163594432
4-[3-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine
CID 155116790
2-(3-dibenzofuran-2-ylphenyl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
CID 176837493
2-(3-dibenzofuran-2-ylphenyl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 138729915
[4-[4-[3-(4-dibenzofuran-2-ylphenyl)phenyl]phenyl]phenyl]-trimethylsilane
CID 171056465
2-[3-(4-phenylphenyl)phenyl]-8-(3-triphenylen-2-ylphenyl)dibenzofuran
CID 118349959
2-[4-[(4-dibenzofuran-2-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]dibenzofuran
CID 59136885
3-dibenzofuran-2-yl-N-(3-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-2-ylphenyl)aniline
CID 118428337
2-[3-(9,10-diphenylanthracen-2-yl)-5-(3-phenylphenyl)phenyl]dibenzofuran
CID 58261864
2-[10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]dibenzofuran
CID 135208803

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran?
The IUPAC name of 2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran (CID 171056558) is 2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran.
What is the SMILES notation for 2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran?
The canonical SMILES for 2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran is Fc1cccc(-c2ccc(-c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)cc2)c1.
What is the InChIKey of 2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran?
The InChIKey is JQDWFDGOPIKHMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H19FO/c31-26-5-3-4-24(18-26)22-12-8-20(9-13-22)21-10-14-23(15-11-21)25-16-17-30-28(19-25)27-6-1-2-7-29(27)32-30/h1-19H.
What are the key properties of 2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran?
2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran has a molecular weight of 414.48 g/mol, XLogP of 8.73, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran is sourced from PubChem (CID 171056558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).