6,7-dihydroxy-2-phenylchromen-4-one

C15H10O4 — CID 5353357

IUPAC6,7-dihydroxy-2-phenylchromen-4-one
SMILESO=c1cc(-c2ccccc2)oc2cc(O)c(O)cc12
InChIInChI=1S/C15H10O4/c16-11-7-14(9-4-2-1-3-5-9)19-15-8-13(18)12(17)6-10(11)15/h1-8,17-18H
InChIKeyGSAOUZGPXSGVRS-UHFFFAOYSA-N
MW254.24 g/mol
LogP2.87
Rot. Bonds1

About 6,7-dihydroxy-2-phenylchromen-4-one

6,7-dihydroxy-2-phenylchromen-4-one (PubChem CID 5353357) has the molecular formula C15H10O4 and a molecular weight of 254.24 g/mol. Its IUPAC name is 6,7-dihydroxy-2-phenylchromen-4-one.

Molecular Properties

Compound Name6,7-dihydroxy-2-phenylchromen-4-one
PubChem CID5353357
Molecular FormulaC15H10O4
Molecular Weight254.24 g/mol
Exact Mass254.06
IUPAC Name6,7-dihydroxy-2-phenylchromen-4-one
SMILESO=c1cc(-c2ccccc2)oc2cc(O)c(O)cc12
InChIInChI=1S/C15H10O4/c16-11-7-14(9-4-2-1-3-5-9)19-15-8-13(18)12(17)6-10(11)15/h1-8,17-18H
InChIKeyGSAOUZGPXSGVRS-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol_A(92)', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

Analyze 6,7-dihydroxy-2-phenylchromen-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6,7-dihydroxy-2-phenylchromen-4-one?
The IUPAC name of 6,7-dihydroxy-2-phenylchromen-4-one (CID 5353357) is 6,7-dihydroxy-2-phenylchromen-4-one.
What is the SMILES notation for 6,7-dihydroxy-2-phenylchromen-4-one?
The canonical SMILES for 6,7-dihydroxy-2-phenylchromen-4-one is O=c1cc(-c2ccccc2)oc2cc(O)c(O)cc12.
What is the InChIKey of 6,7-dihydroxy-2-phenylchromen-4-one?
The InChIKey is GSAOUZGPXSGVRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10O4/c16-11-7-14(9-4-2-1-3-5-9)19-15-8-13(18)12(17)6-10(11)15/h1-8,17-18H.
What are the key properties of 6,7-dihydroxy-2-phenylchromen-4-one?
6,7-dihydroxy-2-phenylchromen-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 6,7-dihydroxy-2-phenylchromen-4-one is sourced from PubChem (CID 5353357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).