About methylarsanylsodium
methylarsanylsodium (PubChem CID 159684378) has the molecular formula CH4AsNa
and a molecular weight of 113.95 g/mol. Its IUPAC name is methylarsanylsodium.
Molecular Properties
| Compound Name | methylarsanylsodium |
| PubChem CID | 159684378 |
| Molecular Formula | CH4AsNa |
| Molecular Weight | 113.95 g/mol |
| Exact Mass | 113.94 |
| IUPAC Name | methylarsanylsodium |
| SMILES | C[AsH][Na] |
| InChI | InChI=1S/CH4As.Na/c1-2;/h2H,1H3;/q-1;+1 |
| InChIKey | QFFZOFQTWTZGAK-UHFFFAOYSA-N |
| XLogP | -0.45 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | |
| Heavy Atoms | 3 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 113.95 |
| LogP ≤ 5 | -0.45 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze methylarsanylsodium 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 methylarsanylsodium?
The IUPAC name of methylarsanylsodium (CID 159684378) is methylarsanylsodium.
What is the SMILES notation for methylarsanylsodium?
The canonical SMILES for methylarsanylsodium is C[AsH][Na].
What is the InChIKey of methylarsanylsodium?
The InChIKey is QFFZOFQTWTZGAK-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4As.Na/c1-2;/h2H,1H3;/q-1;+1.
What are the key properties of methylarsanylsodium?
methylarsanylsodium has a molecular weight of 113.95 g/mol, XLogP of -0.45, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methylarsanylsodium is sourced from PubChem (CID 159684378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).