Phenylselenol

C6H5Se — CID 6327608

IUPAC—
SMILES[Se]c1ccccc1
InChIInChI=1S/C6H5Se/c7-6-4-2-1-3-5-6/h1-5H
InChIKeyYWBHROUQJYHSOR-UHFFFAOYSA-N
MW156.07 g/mol
LogP0.48
Rot. Bonds

About Phenylselenol

Phenylselenol (PubChem CID 6327608) has the molecular formula C6H5Se and a molecular weight of 156.07 g/mol.

Molecular Properties

Compound NamePhenylselenol
PubChem CID6327608
Molecular FormulaC6H5Se
Molecular Weight156.07 g/mol
Exact Mass156.96
IUPAC Name—
SMILES[Se]c1ccccc1
InChIInChI=1S/C6H5Se/c7-6-4-2-1-3-5-6/h1-5H
InChIKeyYWBHROUQJYHSOR-UHFFFAOYSA-N
XLogP0.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.07
LogP ≤ 50.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze Phenylselenol 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 Phenylselenol?
The IUPAC name of Phenylselenol (CID 6327608) is not available.
What is the SMILES notation for Phenylselenol?
The canonical SMILES for Phenylselenol is [Se]c1ccccc1.
What is the InChIKey of Phenylselenol?
The InChIKey is YWBHROUQJYHSOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Se/c7-6-4-2-1-3-5-6/h1-5H.
What are the key properties of Phenylselenol?
Phenylselenol has a molecular weight of 156.07 g/mol, XLogP of 0.48, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for Phenylselenol is sourced from PubChem (CID 6327608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).