About triethyl-[(Z)-3-(2-methylidenebutoxy)-1-triethylsilylprop-2-enyl]silane
triethyl-[(Z)-3-(2-methylidenebutoxy)-1-triethylsilylprop-2-enyl]silane (PubChem CID 135071913) has the molecular formula C20H42OSi2
and a molecular weight of 354.73 g/mol. Its IUPAC name is triethyl-[(Z)-3-(2-methylidenebutoxy)-1-triethylsilylprop-2-enyl]silane.
Molecular Properties
| Compound Name | triethyl-[(Z)-3-(2-methylidenebutoxy)-1-triethylsilylprop-2-enyl]silane |
| PubChem CID | 135071913 |
| Molecular Formula | C20H42OSi2 |
| Molecular Weight | 354.73 g/mol |
| Exact Mass | 354.28 |
| IUPAC Name | triethyl-[(Z)-3-(2-methylidenebutoxy)-1-triethylsilylprop-2-enyl]silane |
| SMILES | C=C(CC)CO/C=C\C([Si](CC)(CC)CC)[Si](CC)(CC)CC |
| InChI | InChI=1S/C20H42OSi2/c1-9-19(8)18-21-17-16-20(22(10-2,11-3)12-4)23(13-5,14-6)15-7/h16-17,20H,8-15,18H2,1-7H3/b17-16- |
| InChIKey | OFUXLADMUYLXBF-MSUUIHNZSA-N |
| XLogP | 7.41 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 13 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 354.73 |
| LogP ≤ 5 | 7.41 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of triethyl-[(Z)-3-(2-methylidenebutoxy)-1-triethylsilylprop-2-enyl]silane?
The IUPAC name of triethyl-[(Z)-3-(2-methylidenebutoxy)-1-triethylsilylprop-2-enyl]silane (CID 135071913) is triethyl-[(Z)-3-(2-methylidenebutoxy)-1-triethylsilylprop-2-enyl]silane.
What is the SMILES notation for triethyl-[(Z)-3-(2-methylidenebutoxy)-1-triethylsilylprop-2-enyl]silane?
The canonical SMILES for triethyl-[(Z)-3-(2-methylidenebutoxy)-1-triethylsilylprop-2-enyl]silane is C=C(CC)CO/C=C\C([Si](CC)(CC)CC)[Si](CC)(CC)CC.
What is the InChIKey of triethyl-[(Z)-3-(2-methylidenebutoxy)-1-triethylsilylprop-2-enyl]silane?
The InChIKey is OFUXLADMUYLXBF-MSUUIHNZSA-N. The full InChI is InChI=1S/C20H42OSi2/c1-9-19(8)18-21-17-16-20(22(10-2,11-3)12-4)23(13-5,14-6)15-7/h16-17,20H,8-15,18H2,1-7H3/b17-16-.
What are the key properties of triethyl-[(Z)-3-(2-methylidenebutoxy)-1-triethylsilylprop-2-enyl]silane?
triethyl-[(Z)-3-(2-methylidenebutoxy)-1-triethylsilylprop-2-enyl]silane has a molecular weight of 354.73 g/mol, XLogP of 7.41, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(Z)-3-(2-methylidenebutoxy)-1-triethylsilylprop-2-enyl]silane is sourced from PubChem (CID 135071913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).