trimethoxy(3-methylsulfinylpropyl)silane

C7H18O4SSi — CID 102191125

IUPACtrimethoxy(3-methylsulfinylpropyl)silane
SMILESCO[Si](CCCS(C)=O)(OC)OC
InChIInChI=1S/C7H18O4SSi/c1-9-13(10-2,11-3)7-5-6-12(4)8/h5-7H2,1-4H3
InChIKeyAEBSNTIDVRHLEA-UHFFFAOYSA-N
MW226.37 g/mol
LogP0.63
Rot. Bonds7

About trimethoxy(3-methylsulfinylpropyl)silane

trimethoxy(3-methylsulfinylpropyl)silane (PubChem CID 102191125) has the molecular formula C7H18O4SSi and a molecular weight of 226.37 g/mol. Its IUPAC name is trimethoxy(3-methylsulfinylpropyl)silane.

Molecular Properties

Compound Nametrimethoxy(3-methylsulfinylpropyl)silane
PubChem CID102191125
Molecular FormulaC7H18O4SSi
Molecular Weight226.37 g/mol
Exact Mass226.07
IUPAC Nametrimethoxy(3-methylsulfinylpropyl)silane
SMILESCO[Si](CCCS(C)=O)(OC)OC
InChIInChI=1S/C7H18O4SSi/c1-9-13(10-2,11-3)7-5-6-12(4)8/h5-7H2,1-4H3
InChIKeyAEBSNTIDVRHLEA-UHFFFAOYSA-N
XLogP0.63
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.37
LogP ≤ 50.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 trimethoxy(3-methylsulfinylpropyl)silane?
The IUPAC name of trimethoxy(3-methylsulfinylpropyl)silane (CID 102191125) is trimethoxy(3-methylsulfinylpropyl)silane.
What is the SMILES notation for trimethoxy(3-methylsulfinylpropyl)silane?
The canonical SMILES for trimethoxy(3-methylsulfinylpropyl)silane is CO[Si](CCCS(C)=O)(OC)OC.
What is the InChIKey of trimethoxy(3-methylsulfinylpropyl)silane?
The InChIKey is AEBSNTIDVRHLEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18O4SSi/c1-9-13(10-2,11-3)7-5-6-12(4)8/h5-7H2,1-4H3.
What are the key properties of trimethoxy(3-methylsulfinylpropyl)silane?
trimethoxy(3-methylsulfinylpropyl)silane has a molecular weight of 226.37 g/mol, XLogP of 0.63, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy(3-methylsulfinylpropyl)silane is sourced from PubChem (CID 102191125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).