2-benzyl-6-methyldibenzofuran

C20H16O — CID 155004540

IUPAC2-benzyl-6-methyldibenzofuran
SMILESCc1cccc2c1oc1ccc(Cc3ccccc3)cc12
InChIInChI=1S/C20H16O/c1-14-6-5-9-17-18-13-16(10-11-19(18)21-20(14)17)12-15-7-3-2-4-8-15/h2-11,13H,12H2,1H3
InChIKeyQUJRDEIRANQPMX-UHFFFAOYSA-N
MW272.35 g/mol
LogP5.49
Rot. Bonds2

About 2-benzyl-6-methyldibenzofuran

2-benzyl-6-methyldibenzofuran (PubChem CID 155004540) has the molecular formula C20H16O and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-benzyl-6-methyldibenzofuran.

Molecular Properties

Compound Name2-benzyl-6-methyldibenzofuran
PubChem CID155004540
Molecular FormulaC20H16O
Molecular Weight272.35 g/mol
Exact Mass272.12
IUPAC Name2-benzyl-6-methyldibenzofuran
SMILESCc1cccc2c1oc1ccc(Cc3ccccc3)cc12
InChIInChI=1S/C20H16O/c1-14-6-5-9-17-18-13-16(10-11-19(18)21-20(14)17)12-15-7-3-2-4-8-15/h2-11,13H,12H2,1H3
InChIKeyQUJRDEIRANQPMX-UHFFFAOYSA-N
XLogP5.49
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500272.35
LogP ≤ 55.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-benzylxanthene-9-thione
CID 88726523
2,8-diethyldibenzofuran;3,7-diethyldibenzofuran;1,6-dimethyldibenzofuran;2,6-dimethyldibenzofuran;2,7-dimethyldibenzofuran;2,8-dimethyldibenzofuran;3,6-dimethyldibenzofuran;3,7-dimethyldibenzofuran
CID 159327549
2-methyl-7-(6-methyldibenzofuran-3-yl)dibenzofuran
CID 139460855
1-methyldibenzofuran;2-methyldibenzofuran;4-methyldibenzofuran
CID 158243493
4-benzyl-2-dibenzofuran-4-yl-5-methylpyridine
CID 162707040
4-benzylbenzonitrile;hydrazine;4-methyldibenzofuran;3-methyl-9-phenylcarbazole
CID 142364455
3,6-dimethyldibenzofuran;ethane
CID 142097287
2-(7-benzyldibenzofuran-4-yl)-5-methyl-4-(2-methylpropyl)pyridine
CID 162707916
3-benzyl-6-(6-benzyl-9-dibenzofuran-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-benzyl-6-(6-benzyl-9-dibenzofuran-3-ylcarbazol-3-yl)-9-phenylcarbazole;3-benzyl-6-(6-benzyl-9-dibenzofuran-4-ylcarbazol-3-yl)-9-phenylcarbazole
CID 162234095
2-[4-[(4-dibenzofuran-4-ylphenyl)methyl]phenyl]dibenzofuran
CID 159612507
2-benzyl-6-methyldibenzothiophene
CID 155004541
4-benzyl-6-methyldibenzofuran;4-bromodibenzofuran;4-bromo-6-methyldibenzofuran;4-methyldibenzofuran;oxolane
CID 159948960

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-6-methyldibenzofuran?
The IUPAC name of 2-benzyl-6-methyldibenzofuran (CID 155004540) is 2-benzyl-6-methyldibenzofuran.
What is the SMILES notation for 2-benzyl-6-methyldibenzofuran?
The canonical SMILES for 2-benzyl-6-methyldibenzofuran is Cc1cccc2c1oc1ccc(Cc3ccccc3)cc12.
What is the InChIKey of 2-benzyl-6-methyldibenzofuran?
The InChIKey is QUJRDEIRANQPMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16O/c1-14-6-5-9-17-18-13-16(10-11-19(18)21-20(14)17)12-15-7-3-2-4-8-15/h2-11,13H,12H2,1H3.
What are the key properties of 2-benzyl-6-methyldibenzofuran?
2-benzyl-6-methyldibenzofuran has a molecular weight of 272.35 g/mol, XLogP of 5.49, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-6-methyldibenzofuran is sourced from PubChem (CID 155004540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).