About methacryloxypropylsilanol
methacryloxypropylsilanol (PubChem CID 21293805) has the molecular formula C7H12O3Si
and a molecular weight of 172.26 g/mol.
Molecular Properties
| Compound Name | methacryloxypropylsilanol |
|---|
| PubChem CID | 21293805 |
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| Molecular Formula | C7H12O3Si |
|---|
| Molecular Weight | 172.26 g/mol |
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| Exact Mass | 172.06 |
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| IUPAC Name | — |
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| SMILES | C=C(C)C(=O)OCCC[Si]O |
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| InChI | InChI=1S/C7H12O3Si/c1-6(2)7(8)10-4-3-5-11-9/h9H,1,3-5H2,2H3 |
|---|
| InChIKey | ZJVHPKZAMIOLST-UHFFFAOYSA-N |
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| XLogP | 0.53 |
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| TPSA | 46.53 Ų |
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| H-Bond Donors | 1 |
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| H-Bond Acceptors | 3 |
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| Rotatable Bonds | 5 |
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| Heavy Atoms | 11 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 172.26 |
| LogP ≤ 5 | 0.53 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of methacryloxypropylsilanol?
The IUPAC name of methacryloxypropylsilanol (CID 21293805) is not available.
What is the SMILES notation for methacryloxypropylsilanol?
The canonical SMILES for methacryloxypropylsilanol is C=C(C)C(=O)OCCC[Si]O.
What is the InChIKey of methacryloxypropylsilanol?
The InChIKey is ZJVHPKZAMIOLST-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O3Si/c1-6(2)7(8)10-4-3-5-11-9/h9H,1,3-5H2,2H3.
What are the key properties of methacryloxypropylsilanol?
methacryloxypropylsilanol has a molecular weight of 172.26 g/mol, XLogP of 0.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methacryloxypropylsilanol is sourced from PubChem (CID 21293805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).