3-Chloromethyl-pyrrolidine-1-carboxylic acid benzyl ester

Base Information

• Chemical Name: 3-Chloromethyl-pyrrolidine-1-carboxylic acid benzyl ester
• CAS No.: 476474-01-8
• Molecular Formula: C13H16ClNO2
• Molecular Weight: 253.72
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID70696035
• Mol file: 476474-01-8.mol

Synonyms:476474-01-8;3-CHLOROMETHYL-PYRROLIDINE-1-CARBOXYLIC ACID BENZYL ESTER;benzyl 3-(chloromethyl)pyrrolidine-1-carboxylate;1187927-26-9;SCHEMBL5235970;DTXSID70696035;BUA47401;MFCD08059345;SB31124;SB31126;SB37294;AM100858;CS-0342440;FT-0750389;benzyl3-(chloromethyl)pyrrolidine-1-carboxylate

Chemical Property of 3-Chloromethyl-pyrrolidine-1-carboxylic acid benzyl ester

Chemical Property:

• PSA: 29.54000
• Density: 1.205
• LogP: 2.82180
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 253.0869564
• Heavy Atom Count: 17
• Complexity: 254

Purity/Quality:

98% ^*data from raw suppliers

3-Chloromethyl-pyrrolidine-1-carboxylicacidbenzylester 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CC1CCl)C(=O)OCC2=CC=CC=C2