selenite

O3Se-2 — CID 1090

IUPACselenite
SMILESO=[Se]([O-])[O-]
InChIInChI=1S/H2O3Se/c1-4(2)3/h(H2,1,2,3)/p-2
InChIKeyMCAHWIHFGHIESP-UHFFFAOYSA-L
MW126.96 g/mol
LogP-2.88
Rot. Bonds

About selenite

selenite (PubChem CID 1090) has the molecular formula O3Se-2 and a molecular weight of 126.96 g/mol. Its IUPAC name is selenite.

Molecular Properties

Compound Nameselenite
PubChem CID1090
Molecular FormulaO3Se-2
Molecular Weight126.96 g/mol
Exact Mass127.90
IUPAC Nameselenite
SMILESO=[Se]([O-])[O-]
InChIInChI=1S/H2O3Se/c1-4(2)3/h(H2,1,2,3)/p-2
InChIKeyMCAHWIHFGHIESP-UHFFFAOYSA-L
XLogP-2.88
TPSA63.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.96
LogP ≤ 5-2.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 selenite?
The IUPAC name of selenite (CID 1090) is selenite.
What is the SMILES notation for selenite?
The canonical SMILES for selenite is O=[Se]([O-])[O-].
What is the InChIKey of selenite?
The InChIKey is MCAHWIHFGHIESP-UHFFFAOYSA-L. The full InChI is InChI=1S/H2O3Se/c1-4(2)3/h(H2,1,2,3)/p-2.
What are the key properties of selenite?
selenite has a molecular weight of 126.96 g/mol, XLogP of -2.88, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for selenite is sourced from PubChem (CID 1090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).