Methyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate

Base Information

• Chemical Name: Methyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate
• CAS No.: 85098-74-4
• Molecular Formula: C14H17 N3 O2
• Molecular Weight: 259.30368
• European Community (EC) Number: 285-426-7
• DSSTox Substance ID: DTXSID10234197
• Nikkaji Number: J309.677G
• Wikidata: Q83115925
• Mol file: 85098-74-4.mol

Synonyms:Methyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate;85098-74-4;EINECS 285-426-7;DTXSID10234197;4-Cyano-4-phenylamino-1-piperidinecarboxylic acid methyl ester

Chemical Property of Methyl 4-cyano-4-(phenylamino)piperidine-1-carboxylate

Chemical Property:

• Vapor Pressure: 2.97E-08mmHg at 25°C
• Boiling Point: 449°C at 760 mmHg
• Flash Point: 225.3°C
• PSA: 65.36000
• Density: 1.21g/cm³
• LogP: 2.23398
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 259.132076794
• Heavy Atom Count: 19
• Complexity: 360

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)N1CCC(CC1)(C#N)NC2=CC=CC=C2