4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one

C10H6F2O3 — CID 67482880

IUPAC4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one
SMILESO=C1OCC(O)=C1c1cc(F)cc(F)c1
InChIInChI=1S/C10H6F2O3/c11-6-1-5(2-7(12)3-6)9-8(13)4-15-10(9)14/h1-3,13H,4H2
InChIKeyLWPDJKRCFODJAA-UHFFFAOYSA-N
MW212.15 g/mol
LogP1.79
Rot. Bonds1

About 4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one

4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one (PubChem CID 67482880) has the molecular formula C10H6F2O3 and a molecular weight of 212.15 g/mol. Its IUPAC name is 4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one.

Molecular Properties

Compound Name4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one
PubChem CID67482880
Molecular FormulaC10H6F2O3
Molecular Weight212.15 g/mol
Exact Mass212.03
IUPAC Name4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one
SMILESO=C1OCC(O)=C1c1cc(F)cc(F)c1
InChIInChI=1S/C10H6F2O3/c11-6-1-5(2-7(12)3-6)9-8(13)4-15-10(9)14/h1-3,13H,4H2
InChIKeyLWPDJKRCFODJAA-UHFFFAOYSA-N
XLogP1.79
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.15
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Vulpinic Acid
CID 54690323
Methyl 2-(3,5-dioxo-4-phenyl-2-furylidene)-2-phenylacetate
CID 54699186
WF 3681
CID 128356
2(5H)Furanone, 3-benzyl-4-hydroxy-
CID 54678489
Benzoic acid, 2,4,6-trifluoro-, ethyl ester
CID 46311438
3-Hydroxy-4-phenyl-2(5H)-furanone
CID 10856006
4-Hydroxy-3-phenylfuran-2(5H)-one
CID 54694085
3,4-Dihydroxy-2,5-diphenyl-2,4-hexa-dienedioic acid methyl ester 3,6-lactone
CID 54684634
diethyl (2Z,4Z)-2-hydroxy-5-phenylhexa-2,4-dienedioate
CID 54733809
3-hydroxy-4-(2-methylphenyl)-2H-furan-5-one
CID 85689586
3-(2-Fluorophenyl)-4-hydroxyfuran-2(5H)-one
CID 67482640
Pulvinone
CID 54678446

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one?
The IUPAC name of 4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one (CID 67482880) is 4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one.
What is the SMILES notation for 4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one?
The canonical SMILES for 4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one is O=C1OCC(O)=C1c1cc(F)cc(F)c1.
What is the InChIKey of 4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one?
The InChIKey is LWPDJKRCFODJAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F2O3/c11-6-1-5(2-7(12)3-6)9-8(13)4-15-10(9)14/h1-3,13H,4H2.
What are the key properties of 4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one?
4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one has a molecular weight of 212.15 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-difluorophenyl)-3-hydroxy-2H-furan-5-one is sourced from PubChem (CID 67482880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).