About trimethyl-[(E)-1-tributylstannylhept-2-en-2-yl]silane
trimethyl-[(E)-1-tributylstannylhept-2-en-2-yl]silane (PubChem CID 11431062) has the molecular formula C22H48SiSn
and a molecular weight of 459.42 g/mol. Its IUPAC name is trimethyl-[(E)-1-tributylstannylhept-2-en-2-yl]silane.
Molecular Properties
| Compound Name | trimethyl-[(E)-1-tributylstannylhept-2-en-2-yl]silane |
| PubChem CID | 11431062 |
| Molecular Formula | C22H48SiSn |
| Molecular Weight | 459.42 g/mol |
| Exact Mass | 460.25 |
| IUPAC Name | trimethyl-[(E)-1-tributylstannylhept-2-en-2-yl]silane |
| SMILES | CCCC/C=C(\C[Sn](CCCC)(CCCC)CCCC)[Si](C)(C)C |
| InChI | InChI=1S/C10H21Si.3C4H9.Sn/c1-6-7-8-9-10(2)11(3,4)5;3*1-3-4-2;/h9H,2,6-8H2,1,3-5H3;3*1,3-4H2,2H3;/b10-9+;;;; |
| InChIKey | INGXPCJFFATPEO-GWIKJDHCSA-N |
| XLogP | 8.83 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 15 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 459.42 |
| LogP ≤ 5 | 8.83 |
| 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 trimethyl-[(E)-1-tributylstannylhept-2-en-2-yl]silane?
The IUPAC name of trimethyl-[(E)-1-tributylstannylhept-2-en-2-yl]silane (CID 11431062) is trimethyl-[(E)-1-tributylstannylhept-2-en-2-yl]silane.
What is the SMILES notation for trimethyl-[(E)-1-tributylstannylhept-2-en-2-yl]silane?
The canonical SMILES for trimethyl-[(E)-1-tributylstannylhept-2-en-2-yl]silane is CCCC/C=C(\C[Sn](CCCC)(CCCC)CCCC)[Si](C)(C)C.
What is the InChIKey of trimethyl-[(E)-1-tributylstannylhept-2-en-2-yl]silane?
The InChIKey is INGXPCJFFATPEO-GWIKJDHCSA-N. The full InChI is InChI=1S/C10H21Si.3C4H9.Sn/c1-6-7-8-9-10(2)11(3,4)5;3*1-3-4-2;/h9H,2,6-8H2,1,3-5H3;3*1,3-4H2,2H3;/b10-9+;;;;.
What are the key properties of trimethyl-[(E)-1-tributylstannylhept-2-en-2-yl]silane?
trimethyl-[(E)-1-tributylstannylhept-2-en-2-yl]silane has a molecular weight of 459.42 g/mol, XLogP of 8.83, 15 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-1-tributylstannylhept-2-en-2-yl]silane is sourced from PubChem (CID 11431062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).