prop-2-enyl 2-trimethylsilyloxyacetate

C8H16O3Si — CID 88550393

IUPACprop-2-enyl 2-trimethylsilyloxyacetate
SMILESC=CCOC(=O)CO[Si](C)(C)C
InChIInChI=1S/C8H16O3Si/c1-5-6-10-8(9)7-11-12(2,3)4/h5H,1,6-7H2,2-4H3
InChIKeyRZBOBOKSDAASHX-UHFFFAOYSA-N
MW188.30 g/mol
LogP1.57
Rot. Bonds5

About prop-2-enyl 2-trimethylsilyloxyacetate

prop-2-enyl 2-trimethylsilyloxyacetate (PubChem CID 88550393) has the molecular formula C8H16O3Si and a molecular weight of 188.30 g/mol. Its IUPAC name is prop-2-enyl 2-trimethylsilyloxyacetate.

Molecular Properties

Compound Nameprop-2-enyl 2-trimethylsilyloxyacetate
PubChem CID88550393
Molecular FormulaC8H16O3Si
Molecular Weight188.30 g/mol
Exact Mass188.09
IUPAC Nameprop-2-enyl 2-trimethylsilyloxyacetate
SMILESC=CCOC(=O)CO[Si](C)(C)C
InChIInChI=1S/C8H16O3Si/c1-5-6-10-8(9)7-11-12(2,3)4/h5H,1,6-7H2,2-4H3
InChIKeyRZBOBOKSDAASHX-UHFFFAOYSA-N
XLogP1.57
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.30
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of prop-2-enyl 2-trimethylsilyloxyacetate?
The IUPAC name of prop-2-enyl 2-trimethylsilyloxyacetate (CID 88550393) is prop-2-enyl 2-trimethylsilyloxyacetate.
What is the SMILES notation for prop-2-enyl 2-trimethylsilyloxyacetate?
The canonical SMILES for prop-2-enyl 2-trimethylsilyloxyacetate is C=CCOC(=O)CO[Si](C)(C)C.
What is the InChIKey of prop-2-enyl 2-trimethylsilyloxyacetate?
The InChIKey is RZBOBOKSDAASHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O3Si/c1-5-6-10-8(9)7-11-12(2,3)4/h5H,1,6-7H2,2-4H3.
What are the key properties of prop-2-enyl 2-trimethylsilyloxyacetate?
prop-2-enyl 2-trimethylsilyloxyacetate has a molecular weight of 188.30 g/mol, XLogP of 1.57, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for prop-2-enyl 2-trimethylsilyloxyacetate is sourced from PubChem (CID 88550393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).