2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran

C23H15FO — CID 91585035

IUPAC2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran
SMILESFc1ccc2oc3ccc(Cc4ccc5ccccc5c4)cc3c2c1
InChIInChI=1S/C23H15FO/c24-19-8-10-23-21(14-19)20-13-16(6-9-22(20)25-23)11-15-5-7-17-3-1-2-4-18(17)12-15/h1-10,12-14H,11H2
InChIKeyOOYHNDFVVKUPNL-UHFFFAOYSA-N
MW326.37 g/mol
LogP6.47
Rot. Bonds2

About 2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran

2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran (PubChem CID 91585035) has the molecular formula C23H15FO and a molecular weight of 326.37 g/mol. Its IUPAC name is 2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran.

Molecular Properties

Compound Name2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran
PubChem CID91585035
Molecular FormulaC23H15FO
Molecular Weight326.37 g/mol
Exact Mass326.11
IUPAC Name2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran
SMILESFc1ccc2oc3ccc(Cc4ccc5ccccc5c4)cc3c2c1
InChIInChI=1S/C23H15FO/c24-19-8-10-23-21(14-19)20-13-16(6-9-22(20)25-23)11-15-5-7-17-3-1-2-4-18(17)12-15/h1-10,12-14H,11H2
InChIKeyOOYHNDFVVKUPNL-UHFFFAOYSA-N
XLogP6.47
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.37
LogP ≤ 56.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran?
The IUPAC name of 2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran (CID 91585035) is 2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran.
What is the SMILES notation for 2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran?
The canonical SMILES for 2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran is Fc1ccc2oc3ccc(Cc4ccc5ccccc5c4)cc3c2c1.
What is the InChIKey of 2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran?
The InChIKey is OOYHNDFVVKUPNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15FO/c24-19-8-10-23-21(14-19)20-13-16(6-9-22(20)25-23)11-15-5-7-17-3-1-2-4-18(17)12-15/h1-10,12-14H,11H2.
What are the key properties of 2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran?
2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran has a molecular weight of 326.37 g/mol, XLogP of 6.47, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-8-(naphthalen-2-ylmethyl)dibenzofuran is sourced from PubChem (CID 91585035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).