1,2-dimethoxy-1-phenylsilolane

C12H18O2Si — CID 175148918

IUPAC1,2-dimethoxy-1-phenylsilolane
SMILESCOC1CCC[Si]1(OC)c1ccccc1
InChIInChI=1S/C12H18O2Si/c1-13-12-9-6-10-15(12,14-2)11-7-4-3-5-8-11/h3-5,7-8,12H,6,9-10H2,1-2H3
InChIKeyLSUAAYDPFXQRSL-UHFFFAOYSA-N
MW222.36 g/mol
LogP1.83
Rot. Bonds3

About 1,2-dimethoxy-1-phenylsilolane

1,2-dimethoxy-1-phenylsilolane (PubChem CID 175148918) has the molecular formula C12H18O2Si and a molecular weight of 222.36 g/mol. Its IUPAC name is 1,2-dimethoxy-1-phenylsilolane.

Molecular Properties

Compound Name1,2-dimethoxy-1-phenylsilolane
PubChem CID175148918
Molecular FormulaC12H18O2Si
Molecular Weight222.36 g/mol
Exact Mass222.11
IUPAC Name1,2-dimethoxy-1-phenylsilolane
SMILESCOC1CCC[Si]1(OC)c1ccccc1
InChIInChI=1S/C12H18O2Si/c1-13-12-9-6-10-15(12,14-2)11-7-4-3-5-8-11/h3-5,7-8,12H,6,9-10H2,1-2H3
InChIKeyLSUAAYDPFXQRSL-UHFFFAOYSA-N
XLogP1.83
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.36
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 1,2-dimethoxy-1-phenylsilolane?
The IUPAC name of 1,2-dimethoxy-1-phenylsilolane (CID 175148918) is 1,2-dimethoxy-1-phenylsilolane.
What is the SMILES notation for 1,2-dimethoxy-1-phenylsilolane?
The canonical SMILES for 1,2-dimethoxy-1-phenylsilolane is COC1CCC[Si]1(OC)c1ccccc1.
What is the InChIKey of 1,2-dimethoxy-1-phenylsilolane?
The InChIKey is LSUAAYDPFXQRSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2Si/c1-13-12-9-6-10-15(12,14-2)11-7-4-3-5-8-11/h3-5,7-8,12H,6,9-10H2,1-2H3.
What are the key properties of 1,2-dimethoxy-1-phenylsilolane?
1,2-dimethoxy-1-phenylsilolane has a molecular weight of 222.36 g/mol, XLogP of 1.83, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethoxy-1-phenylsilolane is sourced from PubChem (CID 175148918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).