2-tripropylsilylacetaldehyde

C11H24OSi — CID 13431041

IUPAC2-tripropylsilylacetaldehyde
SMILESCCC[Si](CC=O)(CCC)CCC
InChIInChI=1S/C11H24OSi/c1-4-8-13(9-5-2,10-6-3)11-7-12/h7H,4-6,8-11H2,1-3H3
InChIKeyXKXJIOKDZYJYSV-UHFFFAOYSA-N
MW200.40 g/mol
LogP3.86
Rot. Bonds8

About 2-tripropylsilylacetaldehyde

2-tripropylsilylacetaldehyde (PubChem CID 13431041) has the molecular formula C11H24OSi and a molecular weight of 200.40 g/mol. Its IUPAC name is 2-tripropylsilylacetaldehyde.

Molecular Properties

Compound Name2-tripropylsilylacetaldehyde
PubChem CID13431041
Molecular FormulaC11H24OSi
Molecular Weight200.40 g/mol
Exact Mass200.16
IUPAC Name2-tripropylsilylacetaldehyde
SMILESCCC[Si](CC=O)(CCC)CCC
InChIInChI=1S/C11H24OSi/c1-4-8-13(9-5-2,10-6-3)11-7-12/h7H,4-6,8-11H2,1-3H3
InChIKeyXKXJIOKDZYJYSV-UHFFFAOYSA-N
XLogP3.86
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.40
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-tripropylsilylacetaldehyde?
The IUPAC name of 2-tripropylsilylacetaldehyde (CID 13431041) is 2-tripropylsilylacetaldehyde.
What is the SMILES notation for 2-tripropylsilylacetaldehyde?
The canonical SMILES for 2-tripropylsilylacetaldehyde is CCC[Si](CC=O)(CCC)CCC.
What is the InChIKey of 2-tripropylsilylacetaldehyde?
The InChIKey is XKXJIOKDZYJYSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24OSi/c1-4-8-13(9-5-2,10-6-3)11-7-12/h7H,4-6,8-11H2,1-3H3.
What are the key properties of 2-tripropylsilylacetaldehyde?
2-tripropylsilylacetaldehyde has a molecular weight of 200.40 g/mol, XLogP of 3.86, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tripropylsilylacetaldehyde is sourced from PubChem (CID 13431041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).