[dimethyl(propoxy)silyl] propanoate

C8H18O3Si — CID 23534071

IUPAC[dimethyl(propoxy)silyl] propanoate
SMILESCCCO[Si](C)(C)OC(=O)CC
InChIInChI=1S/C8H18O3Si/c1-5-7-10-12(3,4)11-8(9)6-2/h5-7H2,1-4H3
InChIKeyFBGCEOAZOBUXLP-UHFFFAOYSA-N
MW190.31 g/mol
LogP2.07
Rot. Bonds5

About [dimethyl(propoxy)silyl] propanoate

[dimethyl(propoxy)silyl] propanoate (PubChem CID 23534071) has the molecular formula C8H18O3Si and a molecular weight of 190.31 g/mol. Its IUPAC name is [dimethyl(propoxy)silyl] propanoate.

Molecular Properties

Compound Name[dimethyl(propoxy)silyl] propanoate
PubChem CID23534071
Molecular FormulaC8H18O3Si
Molecular Weight190.31 g/mol
Exact Mass190.10
IUPAC Name[dimethyl(propoxy)silyl] propanoate
SMILESCCCO[Si](C)(C)OC(=O)CC
InChIInChI=1S/C8H18O3Si/c1-5-7-10-12(3,4)11-8(9)6-2/h5-7H2,1-4H3
InChIKeyFBGCEOAZOBUXLP-UHFFFAOYSA-N
XLogP2.07
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.31
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze [dimethyl(propoxy)silyl] propanoate 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 [dimethyl(propoxy)silyl] propanoate?
The IUPAC name of [dimethyl(propoxy)silyl] propanoate (CID 23534071) is [dimethyl(propoxy)silyl] propanoate.
What is the SMILES notation for [dimethyl(propoxy)silyl] propanoate?
The canonical SMILES for [dimethyl(propoxy)silyl] propanoate is CCCO[Si](C)(C)OC(=O)CC.
What is the InChIKey of [dimethyl(propoxy)silyl] propanoate?
The InChIKey is FBGCEOAZOBUXLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O3Si/c1-5-7-10-12(3,4)11-8(9)6-2/h5-7H2,1-4H3.
What are the key properties of [dimethyl(propoxy)silyl] propanoate?
[dimethyl(propoxy)silyl] propanoate has a molecular weight of 190.31 g/mol, XLogP of 2.07, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethyl(propoxy)silyl] propanoate is sourced from PubChem (CID 23534071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).