1-Isobutyrylpiperidine-3-carboxylic acid

Base Information

• Chemical Name: 1-Isobutyrylpiperidine-3-carboxylic acid
• CAS No.: 926214-33-7
• Molecular Formula: C10H17NO3
• Molecular Weight: 199.24688
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID00588353
• Mol file: 926214-33-7.mol

Synonyms:1-isobutyrylpiperidine-3-carboxylic acid;926214-33-7;1-(2-methylpropanoyl)piperidine-3-carboxylic acid;1-Isobutyryl-3-piperidinecarboxylic acid;SCHEMBL12430299;DTXSID00588353;MFCD09050645;AKOS000134548;AKOS016344096;1-isobutyrylpiperidine-3-carboxylicacid;MCULE-6629287737;SB41734;LS-09394;CS-0244708;EN300-28945;Z85893775

Chemical Property of 1-Isobutyrylpiperidine-3-carboxylic acid

Chemical Property:

• Boiling Point: 381.8±35.0 °C(Predicted)
• PKA: 4.39±0.20(Predicted)
• PSA: 57.61000
• Density: 1.142±0.06 g/cm3(Predicted)
• LogP: 0.90350
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 199.12084340
• Heavy Atom Count: 14
• Complexity: 238

Purity/Quality:

98%min ^*data from raw suppliers

1-Isobutyryl-3-piperidinecarboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(=O)N1CCCC(C1)C(=O)O