2,2-diethoxyethyl(prop-2-enyl)silane

C9H20O2Si — CID 123601754

IUPAC2,2-diethoxyethyl(prop-2-enyl)silane
SMILESC=CC[SiH2]CC(OCC)OCC
InChIInChI=1S/C9H20O2Si/c1-4-7-12-8-9(10-5-2)11-6-3/h4,9H,1,5-8,12H2,2-3H3
InChIKeyAQAOXWTUFJQJDR-UHFFFAOYSA-N
MW188.34 g/mol
LogP1.58
Rot. Bonds8

About 2,2-diethoxyethyl(prop-2-enyl)silane

2,2-diethoxyethyl(prop-2-enyl)silane (PubChem CID 123601754) has the molecular formula C9H20O2Si and a molecular weight of 188.34 g/mol. Its IUPAC name is 2,2-diethoxyethyl(prop-2-enyl)silane.

Molecular Properties

Compound Name2,2-diethoxyethyl(prop-2-enyl)silane
PubChem CID123601754
Molecular FormulaC9H20O2Si
Molecular Weight188.34 g/mol
Exact Mass188.12
IUPAC Name2,2-diethoxyethyl(prop-2-enyl)silane
SMILESC=CC[SiH2]CC(OCC)OCC
InChIInChI=1S/C9H20O2Si/c1-4-7-12-8-9(10-5-2)11-6-3/h4,9H,1,5-8,12H2,2-3H3
InChIKeyAQAOXWTUFJQJDR-UHFFFAOYSA-N
XLogP1.58
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.34
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 2,2-diethoxyethyl(prop-2-enyl)silane?
The IUPAC name of 2,2-diethoxyethyl(prop-2-enyl)silane (CID 123601754) is 2,2-diethoxyethyl(prop-2-enyl)silane.
What is the SMILES notation for 2,2-diethoxyethyl(prop-2-enyl)silane?
The canonical SMILES for 2,2-diethoxyethyl(prop-2-enyl)silane is C=CC[SiH2]CC(OCC)OCC.
What is the InChIKey of 2,2-diethoxyethyl(prop-2-enyl)silane?
The InChIKey is AQAOXWTUFJQJDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O2Si/c1-4-7-12-8-9(10-5-2)11-6-3/h4,9H,1,5-8,12H2,2-3H3.
What are the key properties of 2,2-diethoxyethyl(prop-2-enyl)silane?
2,2-diethoxyethyl(prop-2-enyl)silane has a molecular weight of 188.34 g/mol, XLogP of 1.58, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethoxyethyl(prop-2-enyl)silane is sourced from PubChem (CID 123601754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).