5-fluoro-1-benzofuran

C8H5FO — CID 11788322

IUPAC5-fluoro-1-benzofuran
SMILESFc1ccc2occc2c1
InChIInChI=1S/C8H5FO/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5H
InChIKeyFTVHMXRCGNWCOL-UHFFFAOYSA-N
MW136.12 g/mol
LogP2.57
Rot. Bonds

About 5-fluoro-1-benzofuran

5-fluoro-1-benzofuran (PubChem CID 11788322) has the molecular formula C8H5FO and a molecular weight of 136.12 g/mol. Its IUPAC name is 5-fluoro-1-benzofuran.

Molecular Properties

Compound Name5-fluoro-1-benzofuran
PubChem CID11788322
Molecular FormulaC8H5FO
Molecular Weight136.12 g/mol
Exact Mass136.03
IUPAC Name5-fluoro-1-benzofuran
SMILESFc1ccc2occc2c1
InChIInChI=1S/C8H5FO/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5H
InChIKeyFTVHMXRCGNWCOL-UHFFFAOYSA-N
XLogP2.57
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.12
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-benzofuran?
The IUPAC name of 5-fluoro-1-benzofuran (CID 11788322) is 5-fluoro-1-benzofuran.
What is the SMILES notation for 5-fluoro-1-benzofuran?
The canonical SMILES for 5-fluoro-1-benzofuran is Fc1ccc2occc2c1.
What is the InChIKey of 5-fluoro-1-benzofuran?
The InChIKey is FTVHMXRCGNWCOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5FO/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5H.
What are the key properties of 5-fluoro-1-benzofuran?
5-fluoro-1-benzofuran has a molecular weight of 136.12 g/mol, XLogP of 2.57, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-benzofuran is sourced from PubChem (CID 11788322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).