but-2-enyl(diethoxymethyl)silane

C9H20O2Si — CID 123606759

IUPACbut-2-enyl(diethoxymethyl)silane
SMILESCC=CC[SiH2]C(OCC)OCC
InChIInChI=1S/C9H20O2Si/c1-4-7-8-12-9(10-5-2)11-6-3/h4,7,9H,5-6,8,12H2,1-3H3
InChIKeyIFPJOVKKVJVEOF-UHFFFAOYSA-N
MW188.34 g/mol
LogP1.51
Rot. Bonds7

About but-2-enyl(diethoxymethyl)silane

but-2-enyl(diethoxymethyl)silane (PubChem CID 123606759) has the molecular formula C9H20O2Si and a molecular weight of 188.34 g/mol. Its IUPAC name is but-2-enyl(diethoxymethyl)silane.

Molecular Properties

Compound Namebut-2-enyl(diethoxymethyl)silane
PubChem CID123606759
Molecular FormulaC9H20O2Si
Molecular Weight188.34 g/mol
Exact Mass188.12
IUPAC Namebut-2-enyl(diethoxymethyl)silane
SMILESCC=CC[SiH2]C(OCC)OCC
InChIInChI=1S/C9H20O2Si/c1-4-7-8-12-9(10-5-2)11-6-3/h4,7,9H,5-6,8,12H2,1-3H3
InChIKeyIFPJOVKKVJVEOF-UHFFFAOYSA-N
XLogP1.51
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.34
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of but-2-enyl(diethoxymethyl)silane?
The IUPAC name of but-2-enyl(diethoxymethyl)silane (CID 123606759) is but-2-enyl(diethoxymethyl)silane.
What is the SMILES notation for but-2-enyl(diethoxymethyl)silane?
The canonical SMILES for but-2-enyl(diethoxymethyl)silane is CC=CC[SiH2]C(OCC)OCC.
What is the InChIKey of but-2-enyl(diethoxymethyl)silane?
The InChIKey is IFPJOVKKVJVEOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O2Si/c1-4-7-8-12-9(10-5-2)11-6-3/h4,7,9H,5-6,8,12H2,1-3H3.
What are the key properties of but-2-enyl(diethoxymethyl)silane?
but-2-enyl(diethoxymethyl)silane has a molecular weight of 188.34 g/mol, XLogP of 1.51, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for but-2-enyl(diethoxymethyl)silane is sourced from PubChem (CID 123606759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).