2,2-dimethyl-3-oxoPropanoic acid

Base Information

• Chemical Name: 2,2-dimethyl-3-oxoPropanoic acid
• CAS No.: 68243-82-3
• Molecular Formula: C5H8O3
• Molecular Weight: 116.11500
• DSSTox Substance ID: DTXSID50595077
• Wikidata: Q82490016
• Mol file: 68243-82-3.mol

Synonyms:2,2-dimethyl-3-oxoPropanoic acid;68243-82-3;oxo-pivalic acid;SCHEMBL1255436;DTXSID50595077;AKOS006381344;DA-03654

Chemical Property of 2,2-dimethyl-3-oxoPropanoic acid

Chemical Property:

• PSA: 54.37000
• LogP: 0.29610
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 116.047344113
• Heavy Atom Count: 8
• Complexity: 115

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

2,2-Dimethyl-3-oxopropanoicacid 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C=O)C(=O)O

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