Butanoic acid, 3-oxo-, 2-ethoxy-2-oxoethyl ester

Base Information

• Chemical Name: Butanoic acid, 3-oxo-, 2-ethoxy-2-oxoethyl ester
• CAS No.: 57582-45-3
• Molecular Formula: C₈H₁₂O₅
• Molecular Weight: 188.18
• DSSTox Substance ID: DTXSID80460128
• Wikidata: Q82284056
• Mol file: 57582-45-3.mol

Synonyms:Butanoic acid, 3-oxo-, 2-ethoxy-2-oxoethyl ester;57582-45-3;SCHEMBL12764772;DTXSID80460128;(2-ethoxy-2-oxoethyl) 3-oxobutanoate

Chemical Property of Butanoic acid, 3-oxo-, 2-ethoxy-2-oxoethyl ester

Chemical Property:

• PSA: 69.67000
• LogP: 0.07180
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 188.06847348
• Heavy Atom Count: 13
• Complexity: 209

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)COC(=O)CC(=O)C