dihydroxy(phenyl)-lambda3-iodane

C6H7IO2 — CID 18722130

IUPACdihydroxy(phenyl)-lambda3-iodane
SMILESOI(O)c1ccccc1
InChIInChI=1S/C6H7IO2/c8-7(9)6-4-2-1-3-5-6/h1-5,8-9H
InChIKeyAITWQQFNDLJRIA-UHFFFAOYSA-N
MW238.02 g/mol
LogP1.18
Rot. Bonds1

About dihydroxy(phenyl)-lambda3-iodane

dihydroxy(phenyl)-lambda3-iodane (PubChem CID 18722130) has the molecular formula C6H7IO2 and a molecular weight of 238.02 g/mol. Its IUPAC name is dihydroxy(phenyl)-lambda3-iodane.

Molecular Properties

Compound Namedihydroxy(phenyl)-lambda3-iodane
PubChem CID18722130
Molecular FormulaC6H7IO2
Molecular Weight238.02 g/mol
Exact Mass237.95
IUPAC Namedihydroxy(phenyl)-lambda3-iodane
SMILESOI(O)c1ccccc1
InChIInChI=1S/C6H7IO2/c8-7(9)6-4-2-1-3-5-6/h1-5,8-9H
InChIKeyAITWQQFNDLJRIA-UHFFFAOYSA-N
XLogP1.18
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.02
LogP ≤ 51.18
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 dihydroxy(phenyl)-lambda3-iodane?
The IUPAC name of dihydroxy(phenyl)-lambda3-iodane (CID 18722130) is dihydroxy(phenyl)-lambda3-iodane.
What is the SMILES notation for dihydroxy(phenyl)-lambda3-iodane?
The canonical SMILES for dihydroxy(phenyl)-lambda3-iodane is OI(O)c1ccccc1.
What is the InChIKey of dihydroxy(phenyl)-lambda3-iodane?
The InChIKey is AITWQQFNDLJRIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7IO2/c8-7(9)6-4-2-1-3-5-6/h1-5,8-9H.
What are the key properties of dihydroxy(phenyl)-lambda3-iodane?
dihydroxy(phenyl)-lambda3-iodane has a molecular weight of 238.02 g/mol, XLogP of 1.18, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dihydroxy(phenyl)-lambda3-iodane is sourced from PubChem (CID 18722130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).