About triethyl-[(E)-2-naphthalen-1-ylprop-1-enyl]silane
triethyl-[(E)-2-naphthalen-1-ylprop-1-enyl]silane (PubChem CID 101087823) has the molecular formula C19H26Si
and a molecular weight of 282.50 g/mol. Its IUPAC name is triethyl-[(E)-2-naphthalen-1-ylprop-1-enyl]silane.
Molecular Properties
| Compound Name | triethyl-[(E)-2-naphthalen-1-ylprop-1-enyl]silane |
| PubChem CID | 101087823 |
| Molecular Formula | C19H26Si |
| Molecular Weight | 282.50 g/mol |
| Exact Mass | 282.18 |
| IUPAC Name | triethyl-[(E)-2-naphthalen-1-ylprop-1-enyl]silane |
| SMILES | CC[Si](/C=C(\C)c1cccc2ccccc12)(CC)CC |
| InChI | InChI=1S/C19H26Si/c1-5-20(6-2,7-3)15-16(4)18-14-10-12-17-11-8-9-13-19(17)18/h8-15H,5-7H2,1-4H3/b16-15+ |
| InChIKey | KULKMHYIMWGQKM-FOCLMDBBSA-N |
| XLogP | 6.29 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 5 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 282.50 |
| LogP ≤ 5 | 6.29 |
| 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)-2-naphthalen-1-ylprop-1-enyl]silane?
The IUPAC name of triethyl-[(E)-2-naphthalen-1-ylprop-1-enyl]silane (CID 101087823) is triethyl-[(E)-2-naphthalen-1-ylprop-1-enyl]silane.
What is the SMILES notation for triethyl-[(E)-2-naphthalen-1-ylprop-1-enyl]silane?
The canonical SMILES for triethyl-[(E)-2-naphthalen-1-ylprop-1-enyl]silane is CC[Si](/C=C(\C)c1cccc2ccccc12)(CC)CC.
What is the InChIKey of triethyl-[(E)-2-naphthalen-1-ylprop-1-enyl]silane?
The InChIKey is KULKMHYIMWGQKM-FOCLMDBBSA-N. The full InChI is InChI=1S/C19H26Si/c1-5-20(6-2,7-3)15-16(4)18-14-10-12-17-11-8-9-13-19(17)18/h8-15H,5-7H2,1-4H3/b16-15+.
What are the key properties of triethyl-[(E)-2-naphthalen-1-ylprop-1-enyl]silane?
triethyl-[(E)-2-naphthalen-1-ylprop-1-enyl]silane has a molecular weight of 282.50 g/mol, XLogP of 6.29, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(E)-2-naphthalen-1-ylprop-1-enyl]silane is sourced from PubChem (CID 101087823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).