2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran

C27H22O — CID 67964002

IUPAC2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran
SMILESCC(C)c1ccc(-c2ccc3oc4ccc(-c5ccccc5)cc4c3c2)cc1
InChIInChI=1S/C27H22O/c1-18(2)19-8-10-21(11-9-19)23-13-15-27-25(17-23)24-16-22(12-14-26(24)28-27)20-6-4-3-5-7-20/h3-18H,1-2H3
InChIKeyFOCGRQJXQFMOFV-UHFFFAOYSA-N
MW362.47 g/mol
LogP8.04
Rot. Bonds3

About 2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran

2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran (PubChem CID 67964002) has the molecular formula C27H22O and a molecular weight of 362.47 g/mol. Its IUPAC name is 2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran.

Molecular Properties

Compound Name2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran
PubChem CID67964002
Molecular FormulaC27H22O
Molecular Weight362.47 g/mol
Exact Mass362.17
IUPAC Name2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran
SMILESCC(C)c1ccc(-c2ccc3oc4ccc(-c5ccccc5)cc4c3c2)cc1
InChIInChI=1S/C27H22O/c1-18(2)19-8-10-21(11-9-19)23-13-15-27-25(17-23)24-16-22(12-14-26(24)28-27)20-6-4-3-5-7-20/h3-18H,1-2H3
InChIKeyFOCGRQJXQFMOFV-UHFFFAOYSA-N
XLogP8.04
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.47
LogP ≤ 58.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,8-bis[4-[phenyl-(4-phenylphenyl)methyl]phenyl]dibenzofuran
CID 162785544
2-butan-2-yl-8-phenyldibenzofuran;ethane
CID 142405868
2-[4-[(4-dibenzofuran-2-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]dibenzofuran
CID 59136885
9,27-diphenyl-13,17,21,31-tetraoxanonacyclo[18.14.0.03,18.04,16.06,14.07,12.022,34.024,32.025,30]tetratriaconta-1(20),2,4(16),5,7(12),8,10,14,18,22,24(32),25(30),26,28,33-pentadecaene
CID 58004021
2,8-bis(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran;2,8-bis(6-phenylnaphthalen-2-yl)dibenzofuran;2,8-bis(7-phenylnaphthalen-2-yl)dibenzofuran;2-[7-(cyclodecapentaenyl)naphthalen-2-yl]-8-(7-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran
CID 158865776
ethane;2-(3-methylphenyl)-8-phenyldibenzofuran
CID 143904784
1-phenyl-4-(3-propan-2-ylphenyl)benzene;1-phenyl-4-(4-propan-2-ylphenyl)benzene
CID 160951739
3-chloro-2-methyl-8-phenyldibenzofuran
CID 146616849
2-[3-(4-phenylphenyl)phenyl]-8-(3-triphenylen-2-ylphenyl)dibenzofuran
CID 118349959
7-chloro-2-phenyldibenzofuran
CID 146877075
2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran
CID 58569708
N,4-diphenyl-N-[4-(8-phenyldibenzofuran-2-yl)phenyl]aniline;4-phenyl-N,N-bis(4-phenylphenyl)aniline;4-phenyl-N-[4-(8-phenyldibenzofuran-2-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(8-phenyldibenzofuran-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 158000824

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran?
The IUPAC name of 2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran (CID 67964002) is 2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran.
What is the SMILES notation for 2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran?
The canonical SMILES for 2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran is CC(C)c1ccc(-c2ccc3oc4ccc(-c5ccccc5)cc4c3c2)cc1.
What is the InChIKey of 2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran?
The InChIKey is FOCGRQJXQFMOFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22O/c1-18(2)19-8-10-21(11-9-19)23-13-15-27-25(17-23)24-16-22(12-14-26(24)28-27)20-6-4-3-5-7-20/h3-18H,1-2H3.
What are the key properties of 2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran?
2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran has a molecular weight of 362.47 g/mol, XLogP of 8.04, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran is sourced from PubChem (CID 67964002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).