(R)-1-(tert-Butoxycarbonyl)-2-(2-cyanobenzyl)pyrrolidine-2-carboxylic acid

Base Information

• Chemical Name: (R)-1-(tert-Butoxycarbonyl)-2-(2-cyanobenzyl)pyrrolidine-2-carboxylic acid
• CAS No.: 1217672-44-0
• Molecular Formula: C18H22N2O4
• Molecular Weight: 330.4
• DSSTox Substance ID: DTXSID00375982
• Wikidata: Q82164710
• Mol file: 1217672-44-0.mol

Synonyms:1217672-44-0;(R)-1-(tert-Butoxycarbonyl)-2-(2-cyanobenzyl)pyrrolidine-2-carboxylic acid;(2R)-2-[(2-cyanophenyl)methyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic Acid;BOC-(R)-ALPHA-(2-CYANO-BENZYL)-PROLINE;starbld0000470;DTXSID00375982;MFCD06796806;AKOS015949669;(2R)-1-[(tert-butoxy)carbonyl]-2-[(2-cyanophenyl)methyl]pyrrolidine-2-carboxylic acid

Chemical Property of (R)-1-(tert-Butoxycarbonyl)-2-(2-cyanobenzyl)pyrrolidine-2-carboxylic acid

Chemical Property:

• Storage Temp.: 2-8°C
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 330.15795719
• Heavy Atom Count: 24
• Complexity: 545

Purity/Quality:

98.5% ^*data from raw suppliers

(R)-1-(tert-Butoxycarbonyl)-2-(2-cyanobenzyl)pyrrolidine-2-carboxylicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CCCC1(CC2=CC=CC=C2C#N)C(=O)O
• Isomeric SMILES: CC(C)(C)OC(=O)N1CCC[C@@]1(CC2=CC=CC=C2C#N)C(=O)O