2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde

C8H18O2Si — CID 4187788

IUPAC2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde
SMILESCC(C)(C)[Si](C)(C)OCC=O
InChIInChI=1S/C8H18O2Si/c1-8(2,3)11(4,5)10-7-6-9/h6H,7H2,1-5H3
InChIKeyMEBFFOKESLAUSJ-UHFFFAOYSA-N
MW174.32 g/mol
LogP2.21
Rot. Bonds3

About 2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde

2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde (PubChem CID 4187788) has the molecular formula C8H18O2Si and a molecular weight of 174.32 g/mol. Its IUPAC name is 2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde.

Molecular Properties

Compound Name2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde
PubChem CID4187788
Molecular FormulaC8H18O2Si
Molecular Weight174.32 g/mol
Exact Mass174.11
IUPAC Name2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde
SMILESCC(C)(C)[Si](C)(C)OCC=O
InChIInChI=1S/C8H18O2Si/c1-8(2,3)11(4,5)10-7-6-9/h6H,7H2,1-5H3
InChIKeyMEBFFOKESLAUSJ-UHFFFAOYSA-N
XLogP2.21
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.32
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde?
The IUPAC name of 2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde (CID 4187788) is 2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde.
What is the SMILES notation for 2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde?
The canonical SMILES for 2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde is CC(C)(C)[Si](C)(C)OCC=O.
What is the InChIKey of 2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde?
The InChIKey is MEBFFOKESLAUSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O2Si/c1-8(2,3)11(4,5)10-7-6-9/h6H,7H2,1-5H3.
What are the key properties of 2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde?
2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde has a molecular weight of 174.32 g/mol, XLogP of 2.21, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde is sourced from PubChem (CID 4187788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).