dimethoxy-methyl-phenylsilane

C9H14O2Si — CID 18193

IUPACdimethoxy-methyl-phenylsilane
SMILESCO[Si](C)(OC)c1ccccc1
InChIInChI=1S/C9H14O2Si/c1-10-12(3,11-2)9-7-5-4-6-8-9/h4-8H,1-3H3
InChIKeyCVQVSVBUMVSJES-UHFFFAOYSA-N
MW182.29 g/mol
LogP1.26
Rot. Bonds3

About dimethoxy-methyl-phenylsilane

dimethoxy-methyl-phenylsilane (PubChem CID 18193) has the molecular formula C9H14O2Si and a molecular weight of 182.29 g/mol. Its IUPAC name is dimethoxy-methyl-phenylsilane.

Molecular Properties

Compound Namedimethoxy-methyl-phenylsilane
PubChem CID18193
Molecular FormulaC9H14O2Si
Molecular Weight182.29 g/mol
Exact Mass182.08
IUPAC Namedimethoxy-methyl-phenylsilane
SMILESCO[Si](C)(OC)c1ccccc1
InChIInChI=1S/C9H14O2Si/c1-10-12(3,11-2)9-7-5-4-6-8-9/h4-8H,1-3H3
InChIKeyCVQVSVBUMVSJES-UHFFFAOYSA-N
XLogP1.26
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.29
LogP ≤ 51.26
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 dimethoxy-methyl-phenylsilane?
The IUPAC name of dimethoxy-methyl-phenylsilane (CID 18193) is dimethoxy-methyl-phenylsilane.
What is the SMILES notation for dimethoxy-methyl-phenylsilane?
The canonical SMILES for dimethoxy-methyl-phenylsilane is CO[Si](C)(OC)c1ccccc1.
What is the InChIKey of dimethoxy-methyl-phenylsilane?
The InChIKey is CVQVSVBUMVSJES-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O2Si/c1-10-12(3,11-2)9-7-5-4-6-8-9/h4-8H,1-3H3.
What are the key properties of dimethoxy-methyl-phenylsilane?
dimethoxy-methyl-phenylsilane has a molecular weight of 182.29 g/mol, XLogP of 1.26, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy-methyl-phenylsilane is sourced from PubChem (CID 18193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).