4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran

C33H26O — CID 67964041

IUPAC4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran
SMILESCC(C)c1ccc(-c2ccc(-c3cccc4c3oc3c(-c5ccccc5)cccc34)cc2)cc1
InChIInChI=1S/C33H26O/c1-22(2)23-14-16-24(17-15-23)25-18-20-27(21-19-25)29-11-7-13-31-30-12-6-10-28(32(30)34-33(29)31)26-8-4-3-5-9-26/h3-22H,1-2H3
InChIKeyUQLREHYZCBYPGL-UHFFFAOYSA-N
MW438.57 g/mol
LogP9.71
Rot. Bonds4

About 4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran

4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran (PubChem CID 67964041) has the molecular formula C33H26O and a molecular weight of 438.57 g/mol. Its IUPAC name is 4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran.

Molecular Properties

Compound Name4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran
PubChem CID67964041
Molecular FormulaC33H26O
Molecular Weight438.57 g/mol
Exact Mass438.20
IUPAC Name4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran
SMILESCC(C)c1ccc(-c2ccc(-c3cccc4c3oc3c(-c5ccccc5)cccc34)cc2)cc1
InChIInChI=1S/C33H26O/c1-22(2)23-14-16-24(17-15-23)25-18-20-27(21-19-25)29-11-7-13-31-30-12-6-10-28(32(30)34-33(29)31)26-8-4-3-5-9-26/h3-22H,1-2H3
InChIKeyUQLREHYZCBYPGL-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-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran
CID 67963999
4-[4-[1-(4-phenylphenyl)ethyl]phenyl]dibenzofuran
CID 174178014
2,4-bis(4-phenylphenyl)-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]-1,3,5-triazine
CID 164797297
4-[4-(6-phenyldibenzofuran-4-yl)phenyl]pyridine
CID 171761226
4-(4-phenylphenyl)-6-triphenylen-2-yldibenzofuran
CID 118651099
2-phenyl-4-(3-phenylphenyl)-6-[4-[6-[4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]phenyl]-1,3,5-triazine
CID 177144922
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
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-diphenyl-6-[4-[4-(10-phenylnaphtho[1,2-b][1]benzofuran-5-yl)phenyl]phenyl]-1,3,5-triazine
CID 164834775
2-(10-phenylnaphtho[1,2-b][1]benzofuran-5-yl)-4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 176817618
N-phenyl-4-(6-phenyldibenzofuran-4-yl)-N-[4-(6-phenyldibenzofuran-4-yl)phenyl]aniline
CID 131997663

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran?
The IUPAC name of 4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran (CID 67964041) is 4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran.
What is the SMILES notation for 4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran?
The canonical SMILES for 4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran is CC(C)c1ccc(-c2ccc(-c3cccc4c3oc3c(-c5ccccc5)cccc34)cc2)cc1.
What is the InChIKey of 4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran?
The InChIKey is UQLREHYZCBYPGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H26O/c1-22(2)23-14-16-24(17-15-23)25-18-20-27(21-19-25)29-11-7-13-31-30-12-6-10-28(32(30)34-33(29)31)26-8-4-3-5-9-26/h3-22H,1-2H3.
What are the key properties of 4-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran?
4-phenyl-6-[4-(4-propan-2-ylphenyl)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-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]dibenzofuran is sourced from PubChem (CID 67964041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).