SelenoleSelenol

C4H3Se2 — CID 166450437

IUPAC—
SMILES[Se]c1ccc[se]1
InChIInChI=1S/C4H3Se2/c5-4-2-1-3-6-4/h1-3H
InChIKeyJECMRXGHVMEDDU-UHFFFAOYSA-N
MW208.99 g/mol
LogP-0.46
Rot. Bonds

About SelenoleSelenol

SelenoleSelenol (PubChem CID 166450437) has the molecular formula C4H3Se2 and a molecular weight of 208.99 g/mol.

Molecular Properties

Compound NameSelenoleSelenol
PubChem CID166450437
Molecular FormulaC4H3Se2
Molecular Weight208.99 g/mol
Exact Mass210.86
IUPAC Name—
SMILES[Se]c1ccc[se]1
InChIInChI=1S/C4H3Se2/c5-4-2-1-3-6-4/h1-3H
InChIKeyJECMRXGHVMEDDU-UHFFFAOYSA-N
XLogP-0.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.99
LogP ≤ 5-0.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of SelenoleSelenol?
The IUPAC name of SelenoleSelenol (CID 166450437) is not available.
What is the SMILES notation for SelenoleSelenol?
The canonical SMILES for SelenoleSelenol is [Se]c1ccc[se]1.
What is the InChIKey of SelenoleSelenol?
The InChIKey is JECMRXGHVMEDDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3Se2/c5-4-2-1-3-6-4/h1-3H.
What are the key properties of SelenoleSelenol?
SelenoleSelenol has a molecular weight of 208.99 g/mol, XLogP of -0.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for SelenoleSelenol is sourced from PubChem (CID 166450437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).