4,5-Dihydro-4,4-dimethyl-5-oxo-3-isoxazolepropanoic acid

Base Information

• Chemical Name: 4,5-Dihydro-4,4-dimethyl-5-oxo-3-isoxazolepropanoic acid
• CAS No.: 81659-65-6
• Molecular Formula: C₈H₁₁NO₄
• Molecular Weight: 185.18
• DSSTox Substance ID: DTXSID601199686

Synonyms:DTXSID601199686;81659-65-6;4,5-Dihydro-4,4-dimethyl-5-oxo-3-isoxazolepropanoic acid

Chemical Property of 4,5-Dihydro-4,4-dimethyl-5-oxo-3-isoxazolepropanoic acid

Chemical Property:

• XLogP3: 0.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 185.06880783
• Heavy Atom Count: 13
• Complexity: 280

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C(=NOC1=O)CCC(=O)O)C

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