About triethyl-[(E)-3-trimethylsilylprop-2-enyl]alumanuide
triethyl-[(E)-3-trimethylsilylprop-2-enyl]alumanuide (PubChem CID 134889527) has the molecular formula C12H28AlSi-
and a molecular weight of 227.42 g/mol. Its IUPAC name is triethyl-[(E)-3-trimethylsilylprop-2-enyl]alumanuide.
Molecular Properties
| Compound Name | triethyl-[(E)-3-trimethylsilylprop-2-enyl]alumanuide |
| PubChem CID | 134889527 |
| Molecular Formula | C12H28AlSi- |
| Molecular Weight | 227.42 g/mol |
| Exact Mass | 227.18 |
| IUPAC Name | triethyl-[(E)-3-trimethylsilylprop-2-enyl]alumanuide |
| SMILES | CC[Al-](CC)(CC)C/C=C/[Si](C)(C)C |
| InChI | InChI=1S/C6H13Si.3C2H5.Al/c1-5-6-7(2,3)4;3*1-2;/h5-6H,1H2,2-4H3;3*1H2,2H3;/q;;;;-1/b6-5+;;;; |
| InChIKey | WFMPQMBOIDLSBX-WPYDVODASA-N |
| XLogP | 4.93 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 6 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 227.42 |
| LogP ≤ 5 | 4.93 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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 triethyl-[(E)-3-trimethylsilylprop-2-enyl]alumanuide?
The IUPAC name of triethyl-[(E)-3-trimethylsilylprop-2-enyl]alumanuide (CID 134889527) is triethyl-[(E)-3-trimethylsilylprop-2-enyl]alumanuide.
What is the SMILES notation for triethyl-[(E)-3-trimethylsilylprop-2-enyl]alumanuide?
The canonical SMILES for triethyl-[(E)-3-trimethylsilylprop-2-enyl]alumanuide is CC[Al-](CC)(CC)C/C=C/[Si](C)(C)C.
What is the InChIKey of triethyl-[(E)-3-trimethylsilylprop-2-enyl]alumanuide?
The InChIKey is WFMPQMBOIDLSBX-WPYDVODASA-N. The full InChI is InChI=1S/C6H13Si.3C2H5.Al/c1-5-6-7(2,3)4;3*1-2;/h5-6H,1H2,2-4H3;3*1H2,2H3;/q;;;;-1/b6-5+;;;;.
What are the key properties of triethyl-[(E)-3-trimethylsilylprop-2-enyl]alumanuide?
triethyl-[(E)-3-trimethylsilylprop-2-enyl]alumanuide has a molecular weight of 227.42 g/mol, XLogP of 4.93, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(E)-3-trimethylsilylprop-2-enyl]alumanuide is sourced from PubChem (CID 134889527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).