About chloro-[methyl-trimethylsilyloxy-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane
chloro-[methyl-trimethylsilyloxy-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane (PubChem CID 87430712) has the molecular formula C19H47ClO3Si4
and a molecular weight of 471.38 g/mol. Its IUPAC name is chloro-[methyl-trimethylsilyloxy-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane.
Molecular Properties
| Compound Name | chloro-[methyl-trimethylsilyloxy-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane |
| PubChem CID | 87430712 |
| Molecular Formula | C19H47ClO3Si4 |
| Molecular Weight | 471.38 g/mol |
| Exact Mass | 470.23 |
| IUPAC Name | chloro-[methyl-trimethylsilyloxy-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane |
| SMILES | CC(C)[Si](Cl)(O[Si](C)(O[Si](C)(C)C)O[Si](C(C)C)(C(C)C)C(C)C)C(C)C |
| InChI | InChI=1S/C19H47ClO3Si4/c1-15(2)26(16(3)4,17(5)6)22-25(14,21-24(11,12)13)23-27(20,18(7)8)19(9)10/h15-19H,1-14H3 |
| InChIKey | QVIKKRUCXFWKKE-UHFFFAOYSA-N |
| XLogP | 8.12 |
| TPSA | 27.69 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Heavy Atoms | 27 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 471.38 |
| LogP ≤ 5 | 8.12 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of chloro-[methyl-trimethylsilyloxy-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane?
The IUPAC name of chloro-[methyl-trimethylsilyloxy-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane (CID 87430712) is chloro-[methyl-trimethylsilyloxy-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane.
What is the SMILES notation for chloro-[methyl-trimethylsilyloxy-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane?
The canonical SMILES for chloro-[methyl-trimethylsilyloxy-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane is CC(C)[Si](Cl)(O[Si](C)(O[Si](C)(C)C)O[Si](C(C)C)(C(C)C)C(C)C)C(C)C.
What is the InChIKey of chloro-[methyl-trimethylsilyloxy-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane?
The InChIKey is QVIKKRUCXFWKKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H47ClO3Si4/c1-15(2)26(16(3)4,17(5)6)22-25(14,21-24(11,12)13)23-27(20,18(7)8)19(9)10/h15-19H,1-14H3.
What are the key properties of chloro-[methyl-trimethylsilyloxy-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane?
chloro-[methyl-trimethylsilyloxy-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane has a molecular weight of 471.38 g/mol, XLogP of 8.12, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-[methyl-trimethylsilyloxy-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane is sourced from PubChem (CID 87430712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).