N-(4-Cyanobenzyl)-2-L-azetidinecarboxamide

Base Information

• Chemical Name: N-(4-Cyanobenzyl)-2-L-azetidinecarboxamide
• CAS No.: 353249-19-1
• Molecular Formula: C12H13N3O
• Molecular Weight: 215.25112
• DSSTox Substance ID: DTXSID20473530
• Nikkaji Number: J1.646.068K
• Wikidata: Q82302985
• Mol file: 353249-19-1.mol

Synonyms:353249-19-1;N-(4-Cyanobenzyl)-2-L-azetidinecarboxamide;(2S)-N-[(4-cyanophenyl)methyl]azetidine-2-carboxamide;SCHEMBL7217303;DTXSID20473530;CID 11816747

Chemical Property of N-(4-Cyanobenzyl)-2-L-azetidinecarboxamide

Chemical Property:

• PSA: 68.41000
• LogP: 1.70548
• Storage Temp.: Refrigerator
• Solubility.: DMSO, Methanol
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 215.105862047
• Heavy Atom Count: 16
• Complexity: 299

Purity/Quality:

95% ^*data from raw suppliers

N-(4-Cyanobenzyl)-2-L-azetidinecarboxamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNC1C(=O)NCC2=CC=C(C=C2)C#N
• Isomeric SMILES: C1CN[C@@H]1C(=O)NCC2=CC=C(C=C2)C#N