2-silylethyl prop-2-enoate

C5H10O2Si — CID 154120955

IUPAC2-silylethyl prop-2-enoate
SMILESC=CC(=O)OCC[SiH3]
InChIInChI=1S/C5H10O2Si/c1-2-5(6)7-3-4-8/h2H,1,3-4H2,8H3
InChIKeySAWPXQNANIHGME-UHFFFAOYSA-N
MW130.22 g/mol
LogP-0.50
Rot. Bonds3

About 2-silylethyl prop-2-enoate

2-silylethyl prop-2-enoate (PubChem CID 154120955) has the molecular formula C5H10O2Si and a molecular weight of 130.22 g/mol. Its IUPAC name is 2-silylethyl prop-2-enoate.

Molecular Properties

Compound Name2-silylethyl prop-2-enoate
PubChem CID154120955
Molecular FormulaC5H10O2Si
Molecular Weight130.22 g/mol
Exact Mass130.05
IUPAC Name2-silylethyl prop-2-enoate
SMILESC=CC(=O)OCC[SiH3]
InChIInChI=1S/C5H10O2Si/c1-2-5(6)7-3-4-8/h2H,1,3-4H2,8H3
InChIKeySAWPXQNANIHGME-UHFFFAOYSA-N
XLogP-0.50
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.22
LogP ≤ 5-0.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 2-silylethyl prop-2-enoate 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 2-silylethyl prop-2-enoate?
The IUPAC name of 2-silylethyl prop-2-enoate (CID 154120955) is 2-silylethyl prop-2-enoate.
What is the SMILES notation for 2-silylethyl prop-2-enoate?
The canonical SMILES for 2-silylethyl prop-2-enoate is C=CC(=O)OCC[SiH3].
What is the InChIKey of 2-silylethyl prop-2-enoate?
The InChIKey is SAWPXQNANIHGME-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O2Si/c1-2-5(6)7-3-4-8/h2H,1,3-4H2,8H3.
What are the key properties of 2-silylethyl prop-2-enoate?
2-silylethyl prop-2-enoate has a molecular weight of 130.22 g/mol, XLogP of -0.50, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-silylethyl prop-2-enoate is sourced from PubChem (CID 154120955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).