4-(3-fluorophenyl)-1-benzofuran

C14H9FO — CID 10751013

IUPAC4-(3-fluorophenyl)-1-benzofuran
SMILESFc1cccc(-c2cccc3occc23)c1
InChIInChI=1S/C14H9FO/c15-11-4-1-3-10(9-11)12-5-2-6-14-13(12)7-8-16-14/h1-9H
InChIKeyYSPMRUSFPKQOIH-UHFFFAOYSA-N
MW212.22 g/mol
LogP4.24
Rot. Bonds1

About 4-(3-fluorophenyl)-1-benzofuran

4-(3-fluorophenyl)-1-benzofuran (PubChem CID 10751013) has the molecular formula C14H9FO and a molecular weight of 212.22 g/mol. Its IUPAC name is 4-(3-fluorophenyl)-1-benzofuran.

Molecular Properties

Compound Name4-(3-fluorophenyl)-1-benzofuran
PubChem CID10751013
Molecular FormulaC14H9FO
Molecular Weight212.22 g/mol
Exact Mass212.06
IUPAC Name4-(3-fluorophenyl)-1-benzofuran
SMILESFc1cccc(-c2cccc3occc23)c1
InChIInChI=1S/C14H9FO/c15-11-4-1-3-10(9-11)12-5-2-6-14-13(12)7-8-16-14/h1-9H
InChIKeyYSPMRUSFPKQOIH-UHFFFAOYSA-N
XLogP4.24
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.22
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(3-fluorophenyl)-1-benzofuran?
The IUPAC name of 4-(3-fluorophenyl)-1-benzofuran (CID 10751013) is 4-(3-fluorophenyl)-1-benzofuran.
What is the SMILES notation for 4-(3-fluorophenyl)-1-benzofuran?
The canonical SMILES for 4-(3-fluorophenyl)-1-benzofuran is Fc1cccc(-c2cccc3occc23)c1.
What is the InChIKey of 4-(3-fluorophenyl)-1-benzofuran?
The InChIKey is YSPMRUSFPKQOIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9FO/c15-11-4-1-3-10(9-11)12-5-2-6-14-13(12)7-8-16-14/h1-9H.
What are the key properties of 4-(3-fluorophenyl)-1-benzofuran?
4-(3-fluorophenyl)-1-benzofuran has a molecular weight of 212.22 g/mol, XLogP of 4.24, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluorophenyl)-1-benzofuran is sourced from PubChem (CID 10751013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).