About cyclopenta-1,3-diene;bis(methanidyl(trimethyl)silane);titanium(3+)
cyclopenta-1,3-diene;bis(methanidyl(trimethyl)silane);titanium(3+) (PubChem CID 173151903) has the molecular formula C13H27Si2Ti
and a molecular weight of 287.40 g/mol. Its IUPAC name is cyclopenta-1,3-diene;bis(methanidyl(trimethyl)silane);titanium(3+).
Molecular Properties
| Compound Name | cyclopenta-1,3-diene;bis(methanidyl(trimethyl)silane);titanium(3+) |
|---|
| PubChem CID | 173151903 |
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| Molecular Formula | C13H27Si2Ti |
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| Molecular Weight | 287.40 g/mol |
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| Exact Mass | 287.11 |
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| IUPAC Name | cyclopenta-1,3-diene;bis(methanidyl(trimethyl)silane);titanium(3+) |
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| SMILES | [C-]1=CC=CC1.[CH2-][Si](C)(C)C.[CH2-][Si](C)(C)C.[Ti+3] |
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| InChI | InChI=1S/C5H5.2C4H11Si.Ti/c1-2-4-5-3-1;2*1-5(2,3)4;/h1-3H,4H2;2*1H2,2-4H3;/q3*-1;+3 |
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| InChIKey | VMQRPKJKDNZCDD-UHFFFAOYSA-N |
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| XLogP | 4.70 |
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| TPSA | 0.00 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | |
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| Rotatable Bonds | |
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| Heavy Atoms | 16 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 287.40 |
| LogP ≤ 5 | 4.70 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of cyclopenta-1,3-diene;bis(methanidyl(trimethyl)silane);titanium(3+)?
The IUPAC name of cyclopenta-1,3-diene;bis(methanidyl(trimethyl)silane);titanium(3+) (CID 173151903) is cyclopenta-1,3-diene;bis(methanidyl(trimethyl)silane);titanium(3+).
What is the SMILES notation for cyclopenta-1,3-diene;bis(methanidyl(trimethyl)silane);titanium(3+)?
The canonical SMILES for cyclopenta-1,3-diene;bis(methanidyl(trimethyl)silane);titanium(3+) is [C-]1=CC=CC1.[CH2-][Si](C)(C)C.[CH2-][Si](C)(C)C.[Ti+3].
What is the InChIKey of cyclopenta-1,3-diene;bis(methanidyl(trimethyl)silane);titanium(3+)?
The InChIKey is VMQRPKJKDNZCDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5.2C4H11Si.Ti/c1-2-4-5-3-1;2*1-5(2,3)4;/h1-3H,4H2;2*1H2,2-4H3;/q3*-1;+3.
What are the key properties of cyclopenta-1,3-diene;bis(methanidyl(trimethyl)silane);titanium(3+)?
cyclopenta-1,3-diene;bis(methanidyl(trimethyl)silane);titanium(3+) has a molecular weight of 287.40 g/mol, XLogP of 4.70, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-1,3-diene;bis(methanidyl(trimethyl)silane);titanium(3+) is sourced from PubChem (CID 173151903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).