About dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane
dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane (PubChem CID 91698399) has the molecular formula C14H32O2Si
and a molecular weight of 260.49 g/mol. Its IUPAC name is dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane.
Molecular Properties
| Compound Name | dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane |
| PubChem CID | 91698399 |
| Molecular Formula | C14H32O2Si |
| Molecular Weight | 260.49 g/mol |
| Exact Mass | 260.22 |
| IUPAC Name | dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane |
| SMILES | CCC(C)CCO[Si](C)(C)OCCCC(C)C |
| InChI | InChI=1S/C14H32O2Si/c1-7-14(4)10-12-16-17(5,6)15-11-8-9-13(2)3/h13-14H,7-12H2,1-6H3 |
| InChIKey | ZABRSOANPHAWOH-UHFFFAOYSA-N |
| XLogP | 4.59 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 260.49 |
| LogP ≤ 5 | 4.59 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane 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 dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane?
The IUPAC name of dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane (CID 91698399) is dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane.
What is the SMILES notation for dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane?
The canonical SMILES for dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane is CCC(C)CCO[Si](C)(C)OCCCC(C)C.
What is the InChIKey of dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane?
The InChIKey is ZABRSOANPHAWOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O2Si/c1-7-14(4)10-12-16-17(5,6)15-11-8-9-13(2)3/h13-14H,7-12H2,1-6H3.
What are the key properties of dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane?
dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane has a molecular weight of 260.49 g/mol, XLogP of 4.59, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane is sourced from PubChem (CID 91698399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).