2-butan-2-yl-8-phenyldibenzofuran;ethane

C24H26O — CID 142405868

IUPAC2-butan-2-yl-8-phenyldibenzofuran;ethane
SMILESCC.CCC(C)c1ccc2oc3ccc(-c4ccccc4)cc3c2c1
InChIInChI=1S/C22H20O.C2H6/c1-3-15(2)17-9-11-21-19(13-17)20-14-18(10-12-22(20)23-21)16-7-5-4-6-8-16;1-2/h4-15H,3H2,1-2H3;1-2H3
InChIKeyLODBPUJHICDZLV-UHFFFAOYSA-N
MW330.47 g/mol
LogP7.79
Rot. Bonds3

About 2-butan-2-yl-8-phenyldibenzofuran;ethane

2-butan-2-yl-8-phenyldibenzofuran;ethane (PubChem CID 142405868) has the molecular formula C24H26O and a molecular weight of 330.47 g/mol. Its IUPAC name is 2-butan-2-yl-8-phenyldibenzofuran;ethane.

Molecular Properties

Compound Name2-butan-2-yl-8-phenyldibenzofuran;ethane
PubChem CID142405868
Molecular FormulaC24H26O
Molecular Weight330.47 g/mol
Exact Mass330.20
IUPAC Name2-butan-2-yl-8-phenyldibenzofuran;ethane
SMILESCC.CCC(C)c1ccc2oc3ccc(-c4ccccc4)cc3c2c1
InChIInChI=1S/C22H20O.C2H6/c1-3-15(2)17-9-11-21-19(13-17)20-14-18(10-12-22(20)23-21)16-7-5-4-6-8-16;1-2/h4-15H,3H2,1-2H3;1-2H3
InChIKeyLODBPUJHICDZLV-UHFFFAOYSA-N
XLogP7.79
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.47
LogP ≤ 57.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-phenyl-8-(4-propan-2-ylphenyl)dibenzofuran
CID 67964002
2-[1-(4-phenylphenyl)propyl]naphtho[2,3-b][1]benzofuran
CID 137455701
2,8-bis[4-[phenyl-(4-phenylphenyl)methyl]phenyl]dibenzofuran
CID 162785544
2-[4-[(4-dibenzofuran-2-ylphenyl)-[4-(4-phenylphenyl)phenyl]methyl]phenyl]dibenzofuran
CID 59136885
2-butan-2-yltriphenylene;ethane;1-methyl-4-(4-methylphenyl)benzene;toluene
CID 144660006
ethane;2-(3-methylphenyl)-8-phenyldibenzofuran
CID 143904784
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
9-(4-butan-2-ylphenyl)-10-(4-phenylphenyl)anthracene
CID 58602181
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
2-[4-(4-butan-2-ylphenyl)phenyl]-5-phenyl-1,3,4-oxadiazole
CID 23522274
N-[4-[4-[N-(4-butan-2-ylphenyl)-4-[3-[4-[N-(4-butan-2-ylphenyl)-4-[4-[4-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]anilino]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 59566466
2-[3-(4-phenylphenyl)phenyl]-8-(3-triphenylen-2-ylphenyl)dibenzofuran
CID 118349959

Frequently Asked Questions

What is the IUPAC name of 2-butan-2-yl-8-phenyldibenzofuran;ethane?
The IUPAC name of 2-butan-2-yl-8-phenyldibenzofuran;ethane (CID 142405868) is 2-butan-2-yl-8-phenyldibenzofuran;ethane.
What is the SMILES notation for 2-butan-2-yl-8-phenyldibenzofuran;ethane?
The canonical SMILES for 2-butan-2-yl-8-phenyldibenzofuran;ethane is CC.CCC(C)c1ccc2oc3ccc(-c4ccccc4)cc3c2c1.
What is the InChIKey of 2-butan-2-yl-8-phenyldibenzofuran;ethane?
The InChIKey is LODBPUJHICDZLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20O.C2H6/c1-3-15(2)17-9-11-21-19(13-17)20-14-18(10-12-22(20)23-21)16-7-5-4-6-8-16;1-2/h4-15H,3H2,1-2H3;1-2H3.
What are the key properties of 2-butan-2-yl-8-phenyldibenzofuran;ethane?
2-butan-2-yl-8-phenyldibenzofuran;ethane has a molecular weight of 330.47 g/mol, XLogP of 7.79, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yl-8-phenyldibenzofuran;ethane is sourced from PubChem (CID 142405868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).