About 3-ethoxypropyl(dimethyl)stannane
3-ethoxypropyl(dimethyl)stannane (PubChem CID 58713847) has the molecular formula C7H18OSn
and a molecular weight of 236.93 g/mol. Its IUPAC name is 3-ethoxypropyl(dimethyl)stannane.
Molecular Properties
| Compound Name | 3-ethoxypropyl(dimethyl)stannane |
| PubChem CID | 58713847 |
| Molecular Formula | C7H18OSn |
| Molecular Weight | 236.93 g/mol |
| Exact Mass | 238.04 |
| IUPAC Name | 3-ethoxypropyl(dimethyl)stannane |
| SMILES | CCOCCC[SnH](C)C |
| InChI | InChI=1S/C5H11O.2CH3.Sn.H/c1-3-5-6-4-2;;;;/h1,3-5H2,2H3;2*1H3;; |
| InChIKey | JTHCVPBLEKAGPK-UHFFFAOYSA-N |
| XLogP | 1.90 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 9 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 236.93 |
| LogP ≤ 5 | 1.90 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
|---|
Analyze 3-ethoxypropyl(dimethyl)stannane 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 3-ethoxypropyl(dimethyl)stannane?
The IUPAC name of 3-ethoxypropyl(dimethyl)stannane (CID 58713847) is 3-ethoxypropyl(dimethyl)stannane.
What is the SMILES notation for 3-ethoxypropyl(dimethyl)stannane?
The canonical SMILES for 3-ethoxypropyl(dimethyl)stannane is CCOCCC[SnH](C)C.
What is the InChIKey of 3-ethoxypropyl(dimethyl)stannane?
The InChIKey is JTHCVPBLEKAGPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11O.2CH3.Sn.H/c1-3-5-6-4-2;;;;/h1,3-5H2,2H3;2*1H3;;.
What are the key properties of 3-ethoxypropyl(dimethyl)stannane?
3-ethoxypropyl(dimethyl)stannane has a molecular weight of 236.93 g/mol, XLogP of 1.90, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxypropyl(dimethyl)stannane is sourced from PubChem (CID 58713847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).