4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol

C14H10O4 — CID 10263752

IUPAC4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol
SMILESOc1ccc2oc(-c3ccc(O)c(O)c3)cc2c1
InChIInChI=1S/C14H10O4/c15-10-2-4-13-9(5-10)7-14(18-13)8-1-3-11(16)12(17)6-8/h1-7,15-17H
InChIKeyZMJFCBVYWJHZIA-UHFFFAOYSA-N
MW242.23 g/mol
LogP3.22
Rot. Bonds1

About 4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol

4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol (PubChem CID 10263752) has the molecular formula C14H10O4 and a molecular weight of 242.23 g/mol. Its IUPAC name is 4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol.

Molecular Properties

Compound Name4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol
PubChem CID10263752
Molecular FormulaC14H10O4
Molecular Weight242.23 g/mol
Exact Mass242.06
IUPAC Name4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol
SMILESOc1ccc2oc(-c3ccc(O)c(O)c3)cc2c1
InChIInChI=1S/C14H10O4/c15-10-2-4-13-9(5-10)7-14(18-13)8-1-3-11(16)12(17)6-8/h1-7,15-17H
InChIKeyZMJFCBVYWJHZIA-UHFFFAOYSA-N
XLogP3.22
TPSA73.83 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.23
LogP ≤ 53.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol 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 4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol?
The IUPAC name of 4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol (CID 10263752) is 4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol.
What is the SMILES notation for 4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol?
The canonical SMILES for 4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol is Oc1ccc2oc(-c3ccc(O)c(O)c3)cc2c1.
What is the InChIKey of 4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol?
The InChIKey is ZMJFCBVYWJHZIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10O4/c15-10-2-4-13-9(5-10)7-14(18-13)8-1-3-11(16)12(17)6-8/h1-7,15-17H.
What are the key properties of 4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol?
4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol has a molecular weight of 242.23 g/mol, XLogP of 3.22, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-hydroxy-1-benzofuran-2-yl)benzene-1,2-diol is sourced from PubChem (CID 10263752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).