About (1-chloro-2-methylpropan-2-yl)silane
(1-chloro-2-methylpropan-2-yl)silane (PubChem CID 123947187) has the molecular formula C4H11ClSi
and a molecular weight of 122.67 g/mol. Its IUPAC name is (1-chloro-2-methylpropan-2-yl)silane.
Molecular Properties
| Compound Name | (1-chloro-2-methylpropan-2-yl)silane |
| PubChem CID | 123947187 |
| Molecular Formula | C4H11ClSi |
| Molecular Weight | 122.67 g/mol |
| Exact Mass | 122.03 |
| IUPAC Name | (1-chloro-2-methylpropan-2-yl)silane |
| SMILES | CC(C)([SiH3])CCl |
| InChI | InChI=1S/C4H11ClSi/c1-4(2,6)3-5/h3H2,1-2,6H3 |
| InChIKey | IOZGPYNHDZPGOG-UHFFFAOYSA-N |
| XLogP | 0.79 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 1 |
| Heavy Atoms | 6 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 122.67 |
| LogP ≤ 5 | 0.79 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze (1-chloro-2-methylpropan-2-yl)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 (1-chloro-2-methylpropan-2-yl)silane?
The IUPAC name of (1-chloro-2-methylpropan-2-yl)silane (CID 123947187) is (1-chloro-2-methylpropan-2-yl)silane.
What is the SMILES notation for (1-chloro-2-methylpropan-2-yl)silane?
The canonical SMILES for (1-chloro-2-methylpropan-2-yl)silane is CC(C)([SiH3])CCl.
What is the InChIKey of (1-chloro-2-methylpropan-2-yl)silane?
The InChIKey is IOZGPYNHDZPGOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11ClSi/c1-4(2,6)3-5/h3H2,1-2,6H3.
What are the key properties of (1-chloro-2-methylpropan-2-yl)silane?
(1-chloro-2-methylpropan-2-yl)silane has a molecular weight of 122.67 g/mol, XLogP of 0.79, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1-chloro-2-methylpropan-2-yl)silane is sourced from PubChem (CID 123947187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).