About 2-[bis[(2-methylpropan-2-yl)oxy]silyl]ethyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane
2-[bis[(2-methylpropan-2-yl)oxy]silyl]ethyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane (PubChem CID 59537906) has the molecular formula C19H44O4Si2
and a molecular weight of 392.73 g/mol. Its IUPAC name is 2-[bis[(2-methylpropan-2-yl)oxy]silyl]ethyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane.
Molecular Properties
| Compound Name | 2-[bis[(2-methylpropan-2-yl)oxy]silyl]ethyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane |
| PubChem CID | 59537906 |
| Molecular Formula | C19H44O4Si2 |
| Molecular Weight | 392.73 g/mol |
| Exact Mass | 392.28 |
| IUPAC Name | 2-[bis[(2-methylpropan-2-yl)oxy]silyl]ethyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane |
| SMILES | CC(C)(C)O[SiH](CC[Si](C)(OC(C)(C)C)OC(C)(C)C)OC(C)(C)C |
| InChI | InChI=1S/C19H44O4Si2/c1-16(2,3)20-24(21-17(4,5)6)14-15-25(13,22-18(7,8)9)23-19(10,11)12/h24H,14-15H2,1-13H3 |
| InChIKey | HHIRUPJHTOVZSC-UHFFFAOYSA-N |
| XLogP | 5.54 |
| TPSA | 36.92 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 392.73 |
| LogP ≤ 5 | 5.54 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of 2-[bis[(2-methylpropan-2-yl)oxy]silyl]ethyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane?
The IUPAC name of 2-[bis[(2-methylpropan-2-yl)oxy]silyl]ethyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane (CID 59537906) is 2-[bis[(2-methylpropan-2-yl)oxy]silyl]ethyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane.
What is the SMILES notation for 2-[bis[(2-methylpropan-2-yl)oxy]silyl]ethyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane?
The canonical SMILES for 2-[bis[(2-methylpropan-2-yl)oxy]silyl]ethyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane is CC(C)(C)O[SiH](CC[Si](C)(OC(C)(C)C)OC(C)(C)C)OC(C)(C)C.
What is the InChIKey of 2-[bis[(2-methylpropan-2-yl)oxy]silyl]ethyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane?
The InChIKey is HHIRUPJHTOVZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H44O4Si2/c1-16(2,3)20-24(21-17(4,5)6)14-15-25(13,22-18(7,8)9)23-19(10,11)12/h24H,14-15H2,1-13H3.
What are the key properties of 2-[bis[(2-methylpropan-2-yl)oxy]silyl]ethyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane?
2-[bis[(2-methylpropan-2-yl)oxy]silyl]ethyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane has a molecular weight of 392.73 g/mol, XLogP of 5.54, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis[(2-methylpropan-2-yl)oxy]silyl]ethyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane is sourced from PubChem (CID 59537906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).