1-Acetyl-2,2,5,5-tetramethyl-3-pyrroline-3-carboxylic acid

Base Information

• Chemical Name: 1-Acetyl-2,2,5,5-tetramethyl-3-pyrroline-3-carboxylic acid
• CAS No.: 887352-25-2
• Molecular Formula: C11H17NO3
• Molecular Weight: 211.26
• DSSTox Substance ID: DTXSID30393477
• Mol file: 887352-25-2.mol

Synonyms:887352-25-2;1-ACETYL-2,2,5,5-TETRAMETHYL-3-PYRROLINE-3-CARBOXYLIC ACID;1-acetyl-2,2,5,5-tetramethylpyrrole-3-carboxylic acid;1-Acetyl-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrole-3-carboxylic acid;DTXSID30393477;MGZCMUMKDRAYPZ-UHFFFAOYSA-N;AKOS030240282;FT-0661380

Chemical Property of 1-Acetyl-2,2,5,5-tetramethyl-3-pyrroline-3-carboxylic acid

Chemical Property:

• Melting Point: >250°C (subl.)
• Boiling Point: 354.8 °C at 760 mmHg
• Flash Point: 168.4 °C
• PSA: 57.61000
• Density: 1.103 g/cm³
• LogP: 1.35460
• Storage Temp.: -20°C Freezer
• Solubility.: Acetone, Dichloromethane, Ethanol, Methanol
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 211.12084340
• Heavy Atom Count: 15
• Complexity: 353

Purity/Quality:

99% ^*data from raw suppliers

1-Acetyl-2,2,5,5-tetramethyl-3-pyrroline-3-carboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)N1C(C=C(C1(C)C)C(=O)O)(C)C