ethyl-dimethoxy-(3-methylsulfanylpropyl)silane

C8H20O2SSi — CID 140674075

IUPACethyl-dimethoxy-(3-methylsulfanylpropyl)silane
SMILESCC[Si](CCCSC)(OC)OC
InChIInChI=1S/C8H20O2SSi/c1-5-12(9-2,10-3)8-6-7-11-4/h5-8H2,1-4H3
InChIKeyDDAQHFMXQHDYKU-UHFFFAOYSA-N
MW208.40 g/mol
LogP2.49
Rot. Bonds7

About ethyl-dimethoxy-(3-methylsulfanylpropyl)silane

ethyl-dimethoxy-(3-methylsulfanylpropyl)silane (PubChem CID 140674075) has the molecular formula C8H20O2SSi and a molecular weight of 208.40 g/mol. Its IUPAC name is ethyl-dimethoxy-(3-methylsulfanylpropyl)silane.

Molecular Properties

Compound Nameethyl-dimethoxy-(3-methylsulfanylpropyl)silane
PubChem CID140674075
Molecular FormulaC8H20O2SSi
Molecular Weight208.40 g/mol
Exact Mass208.10
IUPAC Nameethyl-dimethoxy-(3-methylsulfanylpropyl)silane
SMILESCC[Si](CCCSC)(OC)OC
InChIInChI=1S/C8H20O2SSi/c1-5-12(9-2,10-3)8-6-7-11-4/h5-8H2,1-4H3
InChIKeyDDAQHFMXQHDYKU-UHFFFAOYSA-N
XLogP2.49
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.40
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze ethyl-dimethoxy-(3-methylsulfanylpropyl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethyl-dimethoxy-(3-methylsulfanylpropyl)silane?
The IUPAC name of ethyl-dimethoxy-(3-methylsulfanylpropyl)silane (CID 140674075) is ethyl-dimethoxy-(3-methylsulfanylpropyl)silane.
What is the SMILES notation for ethyl-dimethoxy-(3-methylsulfanylpropyl)silane?
The canonical SMILES for ethyl-dimethoxy-(3-methylsulfanylpropyl)silane is CC[Si](CCCSC)(OC)OC.
What is the InChIKey of ethyl-dimethoxy-(3-methylsulfanylpropyl)silane?
The InChIKey is DDAQHFMXQHDYKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20O2SSi/c1-5-12(9-2,10-3)8-6-7-11-4/h5-8H2,1-4H3.
What are the key properties of ethyl-dimethoxy-(3-methylsulfanylpropyl)silane?
ethyl-dimethoxy-(3-methylsulfanylpropyl)silane has a molecular weight of 208.40 g/mol, XLogP of 2.49, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-dimethoxy-(3-methylsulfanylpropyl)silane is sourced from PubChem (CID 140674075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).