2-(4-hydroxyphenyl)-6-iodophenol

C12H9IO2 — CID 101468011

IUPAC2-(4-hydroxyphenyl)-6-iodophenol
SMILESOc1ccc(-c2cccc(I)c2O)cc1
InChIInChI=1S/C12H9IO2/c13-11-3-1-2-10(12(11)15)8-4-6-9(14)7-5-8/h1-7,14-15H
InChIKeySFYQTAKLBOHXBX-UHFFFAOYSA-N
MW312.11 g/mol
LogP3.37
Rot. Bonds1

About 2-(4-hydroxyphenyl)-6-iodophenol

2-(4-hydroxyphenyl)-6-iodophenol (PubChem CID 101468011) has the molecular formula C12H9IO2 and a molecular weight of 312.11 g/mol. Its IUPAC name is 2-(4-hydroxyphenyl)-6-iodophenol.

Molecular Properties

Compound Name2-(4-hydroxyphenyl)-6-iodophenol
PubChem CID101468011
Molecular FormulaC12H9IO2
Molecular Weight312.11 g/mol
Exact Mass311.96
IUPAC Name2-(4-hydroxyphenyl)-6-iodophenol
SMILESOc1ccc(-c2cccc(I)c2O)cc1
InChIInChI=1S/C12H9IO2/c13-11-3-1-2-10(12(11)15)8-4-6-9(14)7-5-8/h1-7,14-15H
InChIKeySFYQTAKLBOHXBX-UHFFFAOYSA-N
XLogP3.37
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.11
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenyl)-6-iodophenol?
The IUPAC name of 2-(4-hydroxyphenyl)-6-iodophenol (CID 101468011) is 2-(4-hydroxyphenyl)-6-iodophenol.
What is the SMILES notation for 2-(4-hydroxyphenyl)-6-iodophenol?
The canonical SMILES for 2-(4-hydroxyphenyl)-6-iodophenol is Oc1ccc(-c2cccc(I)c2O)cc1.
What is the InChIKey of 2-(4-hydroxyphenyl)-6-iodophenol?
The InChIKey is SFYQTAKLBOHXBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9IO2/c13-11-3-1-2-10(12(11)15)8-4-6-9(14)7-5-8/h1-7,14-15H.
What are the key properties of 2-(4-hydroxyphenyl)-6-iodophenol?
2-(4-hydroxyphenyl)-6-iodophenol has a molecular weight of 312.11 g/mol, XLogP of 3.37, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenyl)-6-iodophenol is sourced from PubChem (CID 101468011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).