dimethoxy-propyl-sulfanylsilane

C5H14O2SSi — CID 54179766

IUPACdimethoxy-propyl-sulfanylsilane
SMILESCCC[Si](S)(OC)OC
InChIInChI=1S/C5H14O2SSi/c1-4-5-9(8,6-2)7-3/h8H,4-5H2,1-3H3
InChIKeyPAZINFNKVDWHBH-UHFFFAOYSA-N
MW166.32 g/mol
LogP1.56
Rot. Bonds4

About dimethoxy-propyl-sulfanylsilane

dimethoxy-propyl-sulfanylsilane (PubChem CID 54179766) has the molecular formula C5H14O2SSi and a molecular weight of 166.32 g/mol. Its IUPAC name is dimethoxy-propyl-sulfanylsilane.

Molecular Properties

Compound Namedimethoxy-propyl-sulfanylsilane
PubChem CID54179766
Molecular FormulaC5H14O2SSi
Molecular Weight166.32 g/mol
Exact Mass166.05
IUPAC Namedimethoxy-propyl-sulfanylsilane
SMILESCCC[Si](S)(OC)OC
InChIInChI=1S/C5H14O2SSi/c1-4-5-9(8,6-2)7-3/h8H,4-5H2,1-3H3
InChIKeyPAZINFNKVDWHBH-UHFFFAOYSA-N
XLogP1.56
TPSA18.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.32
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dimethoxy-propyl-sulfanylsilane?
The IUPAC name of dimethoxy-propyl-sulfanylsilane (CID 54179766) is dimethoxy-propyl-sulfanylsilane.
What is the SMILES notation for dimethoxy-propyl-sulfanylsilane?
The canonical SMILES for dimethoxy-propyl-sulfanylsilane is CCC[Si](S)(OC)OC.
What is the InChIKey of dimethoxy-propyl-sulfanylsilane?
The InChIKey is PAZINFNKVDWHBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14O2SSi/c1-4-5-9(8,6-2)7-3/h8H,4-5H2,1-3H3.
What are the key properties of dimethoxy-propyl-sulfanylsilane?
dimethoxy-propyl-sulfanylsilane has a molecular weight of 166.32 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy-propyl-sulfanylsilane is sourced from PubChem (CID 54179766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).