sodium methaneselenonate

CH3NaO3Se — CID 141310142

IUPACsodium methaneselenonate
SMILESC[Se](=O)(=O)[O-].[Na+]
InChIInChI=1S/CH4O3Se.Na/c1-5(2,3)4;/h1H3,(H,2,3,4);/q;+1/p-1
InChIKeyYZYMCDKKNXZDSO-UHFFFAOYSA-M
MW164.98 g/mol
LogP-4.22
Rot. Bonds

About sodium methaneselenonate

sodium methaneselenonate (PubChem CID 141310142) has the molecular formula CH3NaO3Se and a molecular weight of 164.98 g/mol. Its IUPAC name is sodium methaneselenonate.

Molecular Properties

Compound Namesodium methaneselenonate
PubChem CID141310142
Molecular FormulaCH3NaO3Se
Molecular Weight164.98 g/mol
Exact Mass165.91
IUPAC Namesodium methaneselenonate
SMILESC[Se](=O)(=O)[O-].[Na+]
InChIInChI=1S/CH4O3Se.Na/c1-5(2,3)4;/h1H3,(H,2,3,4);/q;+1/p-1
InChIKeyYZYMCDKKNXZDSO-UHFFFAOYSA-M
XLogP-4.22
TPSA57.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.98
LogP ≤ 5-4.22
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 sodium methaneselenonate?
The IUPAC name of sodium methaneselenonate (CID 141310142) is sodium methaneselenonate.
What is the SMILES notation for sodium methaneselenonate?
The canonical SMILES for sodium methaneselenonate is C[Se](=O)(=O)[O-].[Na+].
What is the InChIKey of sodium methaneselenonate?
The InChIKey is YZYMCDKKNXZDSO-UHFFFAOYSA-M. The full InChI is InChI=1S/CH4O3Se.Na/c1-5(2,3)4;/h1H3,(H,2,3,4);/q;+1/p-1.
What are the key properties of sodium methaneselenonate?
sodium methaneselenonate has a molecular weight of 164.98 g/mol, XLogP of -4.22, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium methaneselenonate is sourced from PubChem (CID 141310142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).