trimethyl(3-methylsulfanylpropoxy)silane

C7H18OSSi — CID 12860860

IUPACtrimethyl(3-methylsulfanylpropoxy)silane
SMILESCSCCCO[Si](C)(C)C
InChIInChI=1S/C7H18OSSi/c1-9-7-5-6-8-10(2,3)4/h5-7H2,1-4H3
InChIKeyLAPCXFKXORXMSV-UHFFFAOYSA-N
MW178.37 g/mol
LogP2.59
Rot. Bonds5

About trimethyl(3-methylsulfanylpropoxy)silane

trimethyl(3-methylsulfanylpropoxy)silane (PubChem CID 12860860) has the molecular formula C7H18OSSi and a molecular weight of 178.37 g/mol. Its IUPAC name is trimethyl(3-methylsulfanylpropoxy)silane.

Molecular Properties

Compound Nametrimethyl(3-methylsulfanylpropoxy)silane
PubChem CID12860860
Molecular FormulaC7H18OSSi
Molecular Weight178.37 g/mol
Exact Mass178.08
IUPAC Nametrimethyl(3-methylsulfanylpropoxy)silane
SMILESCSCCCO[Si](C)(C)C
InChIInChI=1S/C7H18OSSi/c1-9-7-5-6-8-10(2,3)4/h5-7H2,1-4H3
InChIKeyLAPCXFKXORXMSV-UHFFFAOYSA-N
XLogP2.59
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.37
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl(3-methylsulfanylpropoxy)silane?
The IUPAC name of trimethyl(3-methylsulfanylpropoxy)silane (CID 12860860) is trimethyl(3-methylsulfanylpropoxy)silane.
What is the SMILES notation for trimethyl(3-methylsulfanylpropoxy)silane?
The canonical SMILES for trimethyl(3-methylsulfanylpropoxy)silane is CSCCCO[Si](C)(C)C.
What is the InChIKey of trimethyl(3-methylsulfanylpropoxy)silane?
The InChIKey is LAPCXFKXORXMSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18OSSi/c1-9-7-5-6-8-10(2,3)4/h5-7H2,1-4H3.
What are the key properties of trimethyl(3-methylsulfanylpropoxy)silane?
trimethyl(3-methylsulfanylpropoxy)silane has a molecular weight of 178.37 g/mol, XLogP of 2.59, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(3-methylsulfanylpropoxy)silane is sourced from PubChem (CID 12860860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).