1-((S)-3-Chloro 2-methylpropionyl)-L-proline

Base Information

• Chemical Name: 1-((S)-3-Chloro 2-methylpropionyl)-L-proline
• CAS No.: 80141-53-3
• Molecular Formula: C9H14ClNO3
• Molecular Weight: 219.67
• DSSTox Substance ID: DTXSID90431945
• Mol file: 80141-53-3.mol

Synonyms:80141-53-3;1-((S)-3-CHLORO 2-METHYLPROPIONYL)-L-PROLINE;(2S)-1-[(2S)-3-CHLORO-2-METHYLPROPANOYL]PYRROLIDINE-2-CARBOXYLIC ACID;(S)-1-((S)-3-Chloro-2-methylpropanoyl)pyrrolidine-2-carboxylic acid;SCHEMBL5032035;DTXSID90431945;AG-H-21509

Chemical Property of 1-((S)-3-Chloro 2-methylpropionyl)-L-proline

Chemical Property:

• PSA: 57.61000
• LogP: 0.87480
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 219.0662210
• Heavy Atom Count: 14
• Complexity: 244

Purity/Quality:

98.5% ^*data from raw suppliers

1-((S)-3-CHLORO 2-METHYLPROPIONYL)-L-PROLINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CCl)C(=O)N1CCCC1C(=O)O
• Isomeric SMILES: C[C@H](CCl)C(=O)N1CCC[C@H]1C(=O)O