4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one

C10H8O4 — CID 44562547

IUPAC4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one
SMILESO=C1OCC(c2ccc(O)cc2)=C1O
InChIInChI=1S/C10H8O4/c11-7-3-1-6(2-4-7)8-5-14-10(13)9(8)12/h1-4,11-12H,5H2
InChIKeyORMHPTKPKXMBNQ-UHFFFAOYSA-N
MW192.17 g/mol
LogP1.22
Rot. Bonds1

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

4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one (PubChem CID 44562547) has the molecular formula C10H8O4 and a molecular weight of 192.17 g/mol. Its IUPAC name is 4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one.

Molecular Properties

Compound Name4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one
PubChem CID44562547
Molecular FormulaC10H8O4
Molecular Weight192.17 g/mol
Exact Mass192.04
IUPAC Name4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one
SMILESO=C1OCC(c2ccc(O)cc2)=C1O
InChIInChI=1S/C10H8O4/c11-7-3-1-6(2-4-7)8-5-14-10(13)9(8)12/h1-4,11-12H,5H2
InChIKeyORMHPTKPKXMBNQ-UHFFFAOYSA-N
XLogP1.22
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.17
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one?
The IUPAC name of 4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one (CID 44562547) is 4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one.
What is the SMILES notation for 4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one?
The canonical SMILES for 4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one is O=C1OCC(c2ccc(O)cc2)=C1O.
What is the InChIKey of 4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one?
The InChIKey is ORMHPTKPKXMBNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8O4/c11-7-3-1-6(2-4-7)8-5-14-10(13)9(8)12/h1-4,11-12H,5H2.
What are the key properties of 4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one?
4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one has a molecular weight of 192.17 g/mol, XLogP of 1.22, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-(4-hydroxyphenyl)-2H-furan-5-one is sourced from PubChem (CID 44562547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).