4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one

C10H7FO3 — CID 82254166

IUPAC4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one
SMILESO=C1OC(c2ccccc2)C(O)=C1F
InChIInChI=1S/C10H7FO3/c11-7-8(12)9(14-10(7)13)6-4-2-1-3-5-6/h1-5,9,12H
InChIKeySMKDYRZGHDDQRZ-UHFFFAOYSA-N
MW194.16 g/mol
LogP2.02
Rot. Bonds1

About 4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one

4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one (PubChem CID 82254166) has the molecular formula C10H7FO3 and a molecular weight of 194.16 g/mol. Its IUPAC name is 4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one.

Molecular Properties

Compound Name4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one
PubChem CID82254166
Molecular FormulaC10H7FO3
Molecular Weight194.16 g/mol
Exact Mass194.04
IUPAC Name4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one
SMILESO=C1OC(c2ccccc2)C(O)=C1F
InChIInChI=1S/C10H7FO3/c11-7-8(12)9(14-10(7)13)6-4-2-1-3-5-6/h1-5,9,12H
InChIKeySMKDYRZGHDDQRZ-UHFFFAOYSA-N
XLogP2.02
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.16
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one?
The IUPAC name of 4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one (CID 82254166) is 4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one.
What is the SMILES notation for 4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one?
The canonical SMILES for 4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one is O=C1OC(c2ccccc2)C(O)=C1F.
What is the InChIKey of 4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one?
The InChIKey is SMKDYRZGHDDQRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FO3/c11-7-8(12)9(14-10(7)13)6-4-2-1-3-5-6/h1-5,9,12H.
What are the key properties of 4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one?
4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one has a molecular weight of 194.16 g/mol, XLogP of 2.02, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-3-hydroxy-2-phenyl-2H-furan-5-one is sourced from PubChem (CID 82254166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).