2-Acetyl-5-oxohexanoic acid tert-butyl ester

Base Information

• Chemical Name: 2-Acetyl-5-oxohexanoic acid tert-butyl ester
• CAS No.: 35490-06-3
• Molecular Formula: C₁₂H₂₀O₄
• Molecular Weight: 228.288
• DSSTox Substance ID: DTXSID301272902
• Nikkaji Number: J1.063.691D
• Mol file: 35490-06-3.mol

Synonyms:SCHEMBL20077533;DTXSID301272902;1,1-Dimethylethyl 2-acetyl-5-oxohexanoate;2-Acetyl-5-oxohexanoic acid tert-butyl ester;35490-06-3

Chemical Property of 2-Acetyl-5-oxohexanoic acid tert-butyl ester

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 228.13615911
• Heavy Atom Count: 16
• Complexity: 286

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)CCC(C(=O)C)C(=O)OC(C)(C)C