phenyl(selenophen-2-yl)iodanium

C10H8ISe+ — CID 132849340

IUPACphenyl(selenophen-2-yl)iodanium
SMILESc1ccc([I+]c2ccc[se]2)cc1
InChIInChI=1S/C10H8ISe/c1-2-5-9(6-3-1)11-10-7-4-8-12-10/h1-8H/q+1
InChIKeyASZCSHYJTYYUBJ-UHFFFAOYSA-N
MW334.04 g/mol
LogP-1.13
Rot. Bonds2

About phenyl(selenophen-2-yl)iodanium

phenyl(selenophen-2-yl)iodanium (PubChem CID 132849340) has the molecular formula C10H8ISe+ and a molecular weight of 334.04 g/mol. Its IUPAC name is phenyl(selenophen-2-yl)iodanium.

Molecular Properties

Compound Namephenyl(selenophen-2-yl)iodanium
PubChem CID132849340
Molecular FormulaC10H8ISe+
Molecular Weight334.04 g/mol
Exact Mass334.88
IUPAC Namephenyl(selenophen-2-yl)iodanium
SMILESc1ccc([I+]c2ccc[se]2)cc1
InChIInChI=1S/C10H8ISe/c1-2-5-9(6-3-1)11-10-7-4-8-12-10/h1-8H/q+1
InChIKeyASZCSHYJTYYUBJ-UHFFFAOYSA-N
XLogP-1.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.04
LogP ≤ 5-1.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze phenyl(selenophen-2-yl)iodanium 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 phenyl(selenophen-2-yl)iodanium?
The IUPAC name of phenyl(selenophen-2-yl)iodanium (CID 132849340) is phenyl(selenophen-2-yl)iodanium.
What is the SMILES notation for phenyl(selenophen-2-yl)iodanium?
The canonical SMILES for phenyl(selenophen-2-yl)iodanium is c1ccc([I+]c2ccc[se]2)cc1.
What is the InChIKey of phenyl(selenophen-2-yl)iodanium?
The InChIKey is ASZCSHYJTYYUBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ISe/c1-2-5-9(6-3-1)11-10-7-4-8-12-10/h1-8H/q+1.
What are the key properties of phenyl(selenophen-2-yl)iodanium?
phenyl(selenophen-2-yl)iodanium has a molecular weight of 334.04 g/mol, XLogP of -1.13, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl(selenophen-2-yl)iodanium is sourced from PubChem (CID 132849340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).