Methyl 4-(3-chlorophenyl)pyrrolidine-3-carboxylate

Base Information

• Chemical Name: Methyl 4-(3-chlorophenyl)pyrrolidine-3-carboxylate
• CAS No.: 939758-09-5
• Molecular Formula: C12H14ClNO2
• Molecular Weight: 239.07
• DSSTox Substance ID: DTXSID60585626
• Mol file: 939758-09-5.mol

Synonyms:939758-09-5;methyl 4-(3-chlorophenyl)pyrrolidine-3-carboxylate;Trans-methyl 4-(3-chlorophenyl)pyrrolidine-3-carboxylate;METHYL (3R,4S)-4-(3-CHLOROPHENYL)PYRROLIDINE-3-CARBOXYLATE;(3R,4S)-Methyl 4-(3-chlorophenyl)pyrrolidine-3-carboxylate;Methyl 4-(3-chlorophenyl)-3-pyrrolidinecarboxylate;DTXSID60585626;AKOS015851539;EN300-1454066;A844760;F1911-4212;4-(3-chlorophenyl)-3-pyrrolidinecarboxylic acid methyl ester

Chemical Property of Methyl 4-(3-chlorophenyl)pyrrolidine-3-carboxylate

Chemical Property:

• Vapor Pressure: 0.000119mmHg at 25°C
• Boiling Point: 335.6°C at 760 mmHg
• Flash Point: 156.7°C
• PSA: 38.33000
• Density: 1.207g/cm³
• LogP: 2.14480
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 239.0713064
• Heavy Atom Count: 16
• Complexity: 259

Purity/Quality:

98% ^*data from raw suppliers

(3R,4S)-Methyl4-(3-chlorophenyl)pyrrolidine-3-carboxylate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1CNCC1C2=CC(=CC=C2)Cl