4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran

C33H26O — CID 67963999

IUPAC4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran
SMILESCC(C)c1ccc(-c2ccc(-c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc2)cc1
InChIInChI=1S/C33H26O/c1-22(2)23-10-12-24(13-11-23)25-14-16-26(17-15-25)27-18-20-28(21-19-27)29-7-5-8-31-30-6-3-4-9-32(30)34-33(29)31/h3-22H,1-2H3
InChIKeyRJULTTUZMQJUFS-UHFFFAOYSA-N
MW438.57 g/mol
LogP9.71
Rot. Bonds4

About 4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran

4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran (PubChem CID 67963999) has the molecular formula C33H26O and a molecular weight of 438.57 g/mol. Its IUPAC name is 4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran.

Molecular Properties

Compound Name4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran
PubChem CID67963999
Molecular FormulaC33H26O
Molecular Weight438.57 g/mol
Exact Mass438.20
IUPAC Name4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran
SMILESCC(C)c1ccc(-c2ccc(-c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc2)cc1
InChIInChI=1S/C33H26O/c1-22(2)23-10-12-24(13-11-23)25-14-16-26(17-15-25)27-18-20-28(21-19-27)29-7-5-8-31-30-6-3-4-9-32(30)34-33(29)31/h3-22H,1-2H3
InChIKeyRJULTTUZMQJUFS-UHFFFAOYSA-N
XLogP9.71
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500438.57
LogP ≤ 59.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-[4-[1-(4-phenylphenyl)ethyl]phenyl]dibenzofuran
CID 174178014
4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran
CID 67964041
2-[4-(4-propan-2-ylphenyl)naphthalen-1-yl]dibenzofuran;3-[4-(4-propan-2-ylphenyl)naphthalen-1-yl]dibenzofuran;4-[4-(4-propan-2-ylphenyl)naphthalen-1-yl]dibenzofuran;4-[4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]phenyl]dibenzofuran
CID 157495963
2-[4-[1-(4-dibenzofuran-4-ylphenyl)ethyl]phenyl]dibenzofuran
CID 174178018
4-(4-dibenzofuran-4-ylphenyl)aniline
CID 58510844
4-[4-[4-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]phenyl]dibenzofuran
CID 59136660
4-[4-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]dibenzofuran
CID 59137016
4-(4-bromophenyl)dibenzofuran
CID 59022098
2-dibenzofuran-4-yl-5-propan-2-ylpyridine
CID 71236317
2-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-4,6-bis(2-phenylphenyl)-1,3,5-triazine
CID 164942421
4-[3-[4-[bis(4-phenylphenyl)methyl]phenyl]phenyl]dibenzofuran
CID 168845323
2-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-4-phenyl-6-(2-phenylphenyl)-1,3,5-triazine
CID 164942555

Frequently Asked Questions

What is the IUPAC name of 4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran?
The IUPAC name of 4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran (CID 67963999) is 4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran.
What is the SMILES notation for 4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran?
The canonical SMILES for 4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran is CC(C)c1ccc(-c2ccc(-c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc2)cc1.
What is the InChIKey of 4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran?
The InChIKey is RJULTTUZMQJUFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H26O/c1-22(2)23-10-12-24(13-11-23)25-14-16-26(17-15-25)27-18-20-28(21-19-27)29-7-5-8-31-30-6-3-4-9-32(30)34-33(29)31/h3-22H,1-2H3.
What are the key properties of 4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran?
4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran has a molecular weight of 438.57 g/mol, XLogP of 9.71, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran is sourced from PubChem (CID 67963999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).