7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran

C23H18O — CID 166939721

IUPAC7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran
SMILESCc1ccccc1-c1cccc2oc3c4c(ccc3c12)CCC=C4
InChIInChI=1S/C23H18O/c1-15-7-2-4-9-17(15)19-11-6-12-21-22(19)20-14-13-16-8-3-5-10-18(16)23(20)24-21/h2,4-7,9-14H,3,8H2,1H3
InChIKeyXWOWGBSCRXUKJE-UHFFFAOYSA-N
MW310.40 g/mol
LogP6.52
Rot. Bonds1

About 7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran

7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran (PubChem CID 166939721) has the molecular formula C23H18O and a molecular weight of 310.40 g/mol. Its IUPAC name is 7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran.

Molecular Properties

Compound Name7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran
PubChem CID166939721
Molecular FormulaC23H18O
Molecular Weight310.40 g/mol
Exact Mass310.14
IUPAC Name7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran
SMILESCc1ccccc1-c1cccc2oc3c4c(ccc3c12)CCC=C4
InChIInChI=1S/C23H18O/c1-15-7-2-4-9-17(15)19-11-6-12-21-22(19)20-14-13-16-8-3-5-10-18(16)23(20)24-21/h2,4-7,9-14H,3,8H2,1H3
InChIKeyXWOWGBSCRXUKJE-UHFFFAOYSA-N
XLogP6.52
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.40
LogP ≤ 56.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran
CID 166938715
6-methyl-1,2-dihydrochrysene
CID 143566629
2-(6-dibenzofuran-3-yldibenzofuran-1-yl)-4-(7,8-dihydrophenanthren-2-yl)-6-phenyl-1,3,5-triazine
CID 170009814
7-[10-(7,8-dihydrophenanthren-9-yl)anthracen-9-yl]-1,2-dihydronaphtho[1,2-b][1]benzofuran
CID 155205203
1-[10-(6,7-dihydrodibenzofuran-4-yl)anthracen-9-yl]dibenzofuran
CID 135208618
3-[3-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[4-[3-methyl-4-(2-methylphenyl)phenyl]phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline
CID 170022525
2-[5-(6,7-dihydrodibenzofuran-1-yl)naphthalen-1-yl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 170424026
N-(2,3-dihydronaphthalen-1-yl)-N,7-bis(5,6-dihydronaphthalen-1-yl)naphtho[1,2-b][1]benzofuran-5-amine
CID 155440912
7-[10-(2-phenylphenyl)anthracen-9-yl]-1,2-dihydronaphtho[1,2-b][1]benzofuran
CID 155205350
9-(5,6-dihydronaphthalen-1-yl)-3-methyl-2-(2-methylphenyl)carbazole;ethane;1-methylnaphthalene
CID 144691976
CID 175958969
CID 175958969
1,2-dihydrophenanthrene;methane
CID 142233557

Frequently Asked Questions

What is the IUPAC name of 7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran?
The IUPAC name of 7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran (CID 166939721) is 7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran.
What is the SMILES notation for 7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran?
The canonical SMILES for 7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran is Cc1ccccc1-c1cccc2oc3c4c(ccc3c12)CCC=C4.
What is the InChIKey of 7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran?
The InChIKey is XWOWGBSCRXUKJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18O/c1-15-7-2-4-9-17(15)19-11-6-12-21-22(19)20-14-13-16-8-3-5-10-18(16)23(20)24-21/h2,4-7,9-14H,3,8H2,1H3.
What are the key properties of 7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran?
7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran has a molecular weight of 310.40 g/mol, XLogP of 6.52, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methylphenyl)-3,4-dihydronaphtho[1,2-b][1]benzofuran is sourced from PubChem (CID 166939721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).