About 2-methylnonan-2-yl(2-phenylethenyl)silane
2-methylnonan-2-yl(2-phenylethenyl)silane (PubChem CID 173268172) has the molecular formula C18H30Si
and a molecular weight of 274.52 g/mol. Its IUPAC name is 2-methylnonan-2-yl(2-phenylethenyl)silane.
Molecular Properties
| Compound Name | 2-methylnonan-2-yl(2-phenylethenyl)silane |
| PubChem CID | 173268172 |
| Molecular Formula | C18H30Si |
| Molecular Weight | 274.52 g/mol |
| Exact Mass | 274.21 |
| IUPAC Name | 2-methylnonan-2-yl(2-phenylethenyl)silane |
| SMILES | CCCCCCCC(C)(C)[SiH2]C=Cc1ccccc1 |
| InChI | InChI=1S/C18H30Si/c1-4-5-6-7-11-15-18(2,3)19-16-14-17-12-9-8-10-13-17/h8-10,12-14,16H,4-7,11,15,19H2,1-3H3 |
| InChIKey | PEASELZTZPMVJP-UHFFFAOYSA-N |
| XLogP | 5.39 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 9 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 274.52 |
| LogP ≤ 5 | 5.39 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-methylnonan-2-yl(2-phenylethenyl)silane?
The IUPAC name of 2-methylnonan-2-yl(2-phenylethenyl)silane (CID 173268172) is 2-methylnonan-2-yl(2-phenylethenyl)silane.
What is the SMILES notation for 2-methylnonan-2-yl(2-phenylethenyl)silane?
The canonical SMILES for 2-methylnonan-2-yl(2-phenylethenyl)silane is CCCCCCCC(C)(C)[SiH2]C=Cc1ccccc1.
What is the InChIKey of 2-methylnonan-2-yl(2-phenylethenyl)silane?
The InChIKey is PEASELZTZPMVJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30Si/c1-4-5-6-7-11-15-18(2,3)19-16-14-17-12-9-8-10-13-17/h8-10,12-14,16H,4-7,11,15,19H2,1-3H3.
What are the key properties of 2-methylnonan-2-yl(2-phenylethenyl)silane?
2-methylnonan-2-yl(2-phenylethenyl)silane has a molecular weight of 274.52 g/mol, XLogP of 5.39, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylnonan-2-yl(2-phenylethenyl)silane is sourced from PubChem (CID 173268172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).