dichloro-ethoxy-propoxysilane

C5H12Cl2O2Si — CID 87766899

IUPACdichloro-ethoxy-propoxysilane
SMILESCCCO[Si](Cl)(Cl)OCC
InChIInChI=1S/C5H12Cl2O2Si/c1-3-5-9-10(6,7)8-4-2/h3-5H2,1-2H3
InChIKeyIPGKSIWCIAJJJV-UHFFFAOYSA-N
MW203.14 g/mol
LogP2.36
Rot. Bonds5

About dichloro-ethoxy-propoxysilane

dichloro-ethoxy-propoxysilane (PubChem CID 87766899) has the molecular formula C5H12Cl2O2Si and a molecular weight of 203.14 g/mol. Its IUPAC name is dichloro-ethoxy-propoxysilane.

Molecular Properties

Compound Namedichloro-ethoxy-propoxysilane
PubChem CID87766899
Molecular FormulaC5H12Cl2O2Si
Molecular Weight203.14 g/mol
Exact Mass202.00
IUPAC Namedichloro-ethoxy-propoxysilane
SMILESCCCO[Si](Cl)(Cl)OCC
InChIInChI=1S/C5H12Cl2O2Si/c1-3-5-9-10(6,7)8-4-2/h3-5H2,1-2H3
InChIKeyIPGKSIWCIAJJJV-UHFFFAOYSA-N
XLogP2.36
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.14
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dichloro-ethoxy-propoxysilane?
The IUPAC name of dichloro-ethoxy-propoxysilane (CID 87766899) is dichloro-ethoxy-propoxysilane.
What is the SMILES notation for dichloro-ethoxy-propoxysilane?
The canonical SMILES for dichloro-ethoxy-propoxysilane is CCCO[Si](Cl)(Cl)OCC.
What is the InChIKey of dichloro-ethoxy-propoxysilane?
The InChIKey is IPGKSIWCIAJJJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12Cl2O2Si/c1-3-5-9-10(6,7)8-4-2/h3-5H2,1-2H3.
What are the key properties of dichloro-ethoxy-propoxysilane?
dichloro-ethoxy-propoxysilane has a molecular weight of 203.14 g/mol, XLogP of 2.36, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-ethoxy-propoxysilane is sourced from PubChem (CID 87766899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).