1-(1-Ethylpropyl)-5-oxopyrrolidine-3-carboxylic acid

Base Information

• Chemical Name: 1-(1-Ethylpropyl)-5-oxopyrrolidine-3-carboxylic acid
• CAS No.: 944511-54-0
• Molecular Formula: C10H17NO3
• Molecular Weight: 199.25
• DSSTox Substance ID: DTXSID60406488
• Mol file: 944511-54-0.mol

Synonyms:1-(1-ethylpropyl)-5-oxopyrrolidine-3-carboxylic acid;944511-54-0;5-oxo-1-(pentan-3-yl)pyrrolidine-3-carboxylic acid;5-oxo-1-pentan-3-ylpyrrolidine-3-carboxylic acid;SCHEMBL14478051;DTXSID60406488;MFCD07364764;STK502023;AKOS000145976;AKOS016345648;LS-03427;CS-0248701;EN300-41073;4-AMINOAZOBENZENE-4-SULFONICACIDSODIUMSALT;5-oxo-1-(pentan-3-yl)pyrrolidine-3-carboxylicacid;Z239137526

Chemical Property of 1-(1-Ethylpropyl)-5-oxopyrrolidine-3-carboxylic acid

Chemical Property:

• PKA: 4.52±0.20(Predicted)
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 199.12084340
• Heavy Atom Count: 14
• Complexity: 236

Purity/Quality:

98%min ^*data from raw suppliers

1-(1-ethylpropyl)-5-oxopyrrolidine-3-carboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(CC)N1CC(CC1=O)C(=O)O