6-methyl-2-(4-phenylphenyl)-1-benzofuran

C21H16O — CID 21446826

IUPAC6-methyl-2-(4-phenylphenyl)-1-benzofuran
SMILESCc1ccc2cc(-c3ccc(-c4ccccc4)cc3)oc2c1
InChIInChI=1S/C21H16O/c1-15-7-8-19-14-21(22-20(19)13-15)18-11-9-17(10-12-18)16-5-3-2-4-6-16/h2-14H,1H3
InChIKeyBLCOSZIACYWPIH-UHFFFAOYSA-N
MW284.36 g/mol
LogP6.08
Rot. Bonds2

About 6-methyl-2-(4-phenylphenyl)-1-benzofuran

6-methyl-2-(4-phenylphenyl)-1-benzofuran (PubChem CID 21446826) has the molecular formula C21H16O and a molecular weight of 284.36 g/mol. Its IUPAC name is 6-methyl-2-(4-phenylphenyl)-1-benzofuran.

Molecular Properties

Compound Name6-methyl-2-(4-phenylphenyl)-1-benzofuran
PubChem CID21446826
Molecular FormulaC21H16O
Molecular Weight284.36 g/mol
Exact Mass284.12
IUPAC Name6-methyl-2-(4-phenylphenyl)-1-benzofuran
SMILESCc1ccc2cc(-c3ccc(-c4ccccc4)cc3)oc2c1
InChIInChI=1S/C21H16O/c1-15-7-8-19-14-21(22-20(19)13-15)18-11-9-17(10-12-18)16-5-3-2-4-6-16/h2-14H,1H3
InChIKeyBLCOSZIACYWPIH-UHFFFAOYSA-N
XLogP6.08
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.36
LogP ≤ 56.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[4-(3-methylphenyl)phenyl]-1-benzofuran
CID 132966930
N,N-diethyl-4-(6-methyl-1-benzofuran-2-yl)aniline
CID 146488900
2-phenylfuro[3,2-g]chromen-7-one
CID 102313013
(2-phenyl-1-benzofuran-6-yl)methanol
CID 19840311
2-[4-(5,5,15,15,22,25,25-heptamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19(24),20,22,26-dodecaenyl)phenyl]-1-benzofuran
CID 59413380
6-(3-methylphenyl)-2-[6-(3-methylphenyl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran
CID 145031024
methane;2-methyl-6-phenylnaphthalene
CID 144703390
6-methyl-1-benzofuran;toluene
CID 156726353
N-[4-(1-benzofuran-2-yl)phenyl]-N-[4-[4-(1-benzofuran-2-yl)phenyl]phenyl]-4-phenylaniline;N,N-bis[4-(1-benzofuran-2-yl)phenyl]-4-naphthalen-2-ylaniline;N,N-bis[4-(1-benzofuran-2-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)aniline;N,4-bis[4-(1-benzofuran-2-yl)phenyl]-N-(4-naphthalen-2-ylphenyl)aniline
CID 165046109
N,N-bis[4-[4-(1-benzofuran-2-yl)phenyl]phenyl]naphthalen-2-amine;N,N-bis[4-[4-(1-benzofuran-2-yl)phenyl]phenyl]-4-phenylaniline
CID 165085656
2-[4-(1-benzofuran-2-yl)phenyl]-4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 146183190
2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran
CID 141017099

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(4-phenylphenyl)-1-benzofuran?
The IUPAC name of 6-methyl-2-(4-phenylphenyl)-1-benzofuran (CID 21446826) is 6-methyl-2-(4-phenylphenyl)-1-benzofuran.
What is the SMILES notation for 6-methyl-2-(4-phenylphenyl)-1-benzofuran?
The canonical SMILES for 6-methyl-2-(4-phenylphenyl)-1-benzofuran is Cc1ccc2cc(-c3ccc(-c4ccccc4)cc3)oc2c1.
What is the InChIKey of 6-methyl-2-(4-phenylphenyl)-1-benzofuran?
The InChIKey is BLCOSZIACYWPIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16O/c1-15-7-8-19-14-21(22-20(19)13-15)18-11-9-17(10-12-18)16-5-3-2-4-6-16/h2-14H,1H3.
What are the key properties of 6-methyl-2-(4-phenylphenyl)-1-benzofuran?
6-methyl-2-(4-phenylphenyl)-1-benzofuran has a molecular weight of 284.36 g/mol, XLogP of 6.08, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(4-phenylphenyl)-1-benzofuran is sourced from PubChem (CID 21446826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).