1-(3-Cyanopyridin-2-YL)piperidine-4-carboxylic acid

Base Information

• Chemical Name: 1-(3-Cyanopyridin-2-YL)piperidine-4-carboxylic acid
• CAS No.: 939986-70-6
• Molecular Formula: C12H13N3O2
• Molecular Weight: 231.25
• DSSTox Substance ID: DTXSID401221538
• Mol file: 939986-70-6.mol

Synonyms:939986-70-6;1-(3-CYANOPYRIDIN-2-YL)PIPERIDINE-4-CARBOXYLIC ACID;3'-Cyano-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-4-carboxylic acid;1-(3-Cyano-2-pyridinyl)-4-piperidinecarboxylic acid;SCHEMBL3110161;DTXSID401221538;AKOS000144518;G73810;1-(3-cyano-2-pyridyl)-4-piperidinecarboxylic acid;Z86239282;1-(3-CYANOPYRIDIN-2-YL)PIPERIDINE-4-CARBOXYLICACID;3'-Cyano-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-4-carboxylic acid, AldrichCPR;3'-Cyano-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-4-carboxylic acid, 98+% C12H13N3O2, MW: 231.25

Chemical Property of 1-(3-Cyanopyridin-2-YL)piperidine-4-carboxylic acid

Chemical Property:

• PSA: 77.22000
• Density: 1.32
• LogP: 1.31928
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 231.100776666
• Heavy Atom Count: 17
• Complexity: 328

Purity/Quality:

≥95% ^*data from raw suppliers

1-(3-Cyanopyridin-2-yl)piperidine-4-carboxylicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCC1C(=O)O)C2=C(C=CC=N2)C#N