6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one

C15H10O4 — CID 688662

IUPAC6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one
SMILESO=c1cc(-c2cccc(O)c2)oc2ccc(O)cc12
InChIInChI=1S/C15H10O4/c16-10-3-1-2-9(6-10)15-8-13(18)12-7-11(17)4-5-14(12)19-15/h1-8,16-17H
InChIKeyYHLLABKHTFWHSZ-UHFFFAOYSA-N
MW254.24 g/mol
LogP2.87
Rot. Bonds1

About 6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one

6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one (PubChem CID 688662) has the molecular formula C15H10O4 and a molecular weight of 254.24 g/mol. Its IUPAC name is 6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one.

Molecular Properties

Compound Name6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one
PubChem CID688662
Molecular FormulaC15H10O4
Molecular Weight254.24 g/mol
Exact Mass254.06
IUPAC Name6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one
SMILESO=c1cc(-c2cccc(O)c2)oc2ccc(O)cc12
InChIInChI=1S/C15H10O4/c16-10-3-1-2-9(6-10)15-8-13(18)12-7-11(17)4-5-14(12)19-15/h1-8,16-17H
InChIKeyYHLLABKHTFWHSZ-UHFFFAOYSA-N
XLogP2.87
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.24
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one?
The IUPAC name of 6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one (CID 688662) is 6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one.
What is the SMILES notation for 6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one?
The canonical SMILES for 6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one is O=c1cc(-c2cccc(O)c2)oc2ccc(O)cc12.
What is the InChIKey of 6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one?
The InChIKey is YHLLABKHTFWHSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10O4/c16-10-3-1-2-9(6-10)15-8-13(18)12-7-11(17)4-5-14(12)19-15/h1-8,16-17H.
What are the key properties of 6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one?
6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one has a molecular weight of 254.24 g/mol, XLogP of 2.87, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-2-(3-hydroxyphenyl)chromen-4-one is sourced from PubChem (CID 688662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).