2-methyl-3-triethoxysilylpropanal

C10H22O4Si — CID 71409533

IUPAC2-methyl-3-triethoxysilylpropanal
SMILESCCO[Si](CC(C)C=O)(OCC)OCC
InChIInChI=1S/C10H22O4Si/c1-5-12-15(13-6-2,14-7-3)9-10(4)8-11/h8,10H,5-7,9H2,1-4H3
InChIKeyYQHQXNHQABNVNA-UHFFFAOYSA-N
MW234.37 g/mol
LogP1.87
Rot. Bonds9

About 2-methyl-3-triethoxysilylpropanal

2-methyl-3-triethoxysilylpropanal (PubChem CID 71409533) has the molecular formula C10H22O4Si and a molecular weight of 234.37 g/mol. Its IUPAC name is 2-methyl-3-triethoxysilylpropanal.

Molecular Properties

Compound Name2-methyl-3-triethoxysilylpropanal
PubChem CID71409533
Molecular FormulaC10H22O4Si
Molecular Weight234.37 g/mol
Exact Mass234.13
IUPAC Name2-methyl-3-triethoxysilylpropanal
SMILESCCO[Si](CC(C)C=O)(OCC)OCC
InChIInChI=1S/C10H22O4Si/c1-5-12-15(13-6-2,14-7-3)9-10(4)8-11/h8,10H,5-7,9H2,1-4H3
InChIKeyYQHQXNHQABNVNA-UHFFFAOYSA-N
XLogP1.87
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.37
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-((Tert-butyldimethylsilyl)oxy)-2-methylpropanal
CID 11041832
4-Triethoxysilylbutyraldehyde
CID 44516815
Propanal, 3-(trimethoxysilyl)-
CID 11805310
3-(Triethoxysilyl)propanal
CID 22118046
(S)-(+)-3-(t-butyldimethylsilyloxy)-2-methylpropanal
CID 10241965
(2R)-3-[(tert-butyldimethylsilyl)oxy]-2-methylpropanal
CID 10965592
Propanal, 2-(trimethoxysilyl)-
CID 11769108
Trimethoxysilylbutanal
CID 87390606
2-Methyl-3-triethylsilyloxypropanal
CID 10655745
(2R)-2-methyl-3-triethylsilyloxypropanal
CID 11241121
(2R)-2-methyl-3-tri(propan-2-yl)silyloxypropanal
CID 11459213
4-(Trimethoxysilyl)butanal
CID 10285853

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-triethoxysilylpropanal?
The IUPAC name of 2-methyl-3-triethoxysilylpropanal (CID 71409533) is 2-methyl-3-triethoxysilylpropanal.
What is the SMILES notation for 2-methyl-3-triethoxysilylpropanal?
The canonical SMILES for 2-methyl-3-triethoxysilylpropanal is CCO[Si](CC(C)C=O)(OCC)OCC.
What is the InChIKey of 2-methyl-3-triethoxysilylpropanal?
The InChIKey is YQHQXNHQABNVNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O4Si/c1-5-12-15(13-6-2,14-7-3)9-10(4)8-11/h8,10H,5-7,9H2,1-4H3.
What are the key properties of 2-methyl-3-triethoxysilylpropanal?
2-methyl-3-triethoxysilylpropanal has a molecular weight of 234.37 g/mol, XLogP of 1.87, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-triethoxysilylpropanal is sourced from PubChem (CID 71409533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).