1,1-Diphenyl-4-piperidino-3-buten-2-one hydrochloride

Base Information

• Chemical Name: 1,1-Diphenyl-4-piperidino-3-buten-2-one hydrochloride
• CAS No.: 100482-64-2
• Molecular Formula: C21H23 N O . Cl H
• Molecular Weight: 0
• Mol file: 100482-64-2.mol

Synonyms:1,1-Diphenyl-4-piperidino-3-buten-2-one hydrochloride;100482-64-2;Piperidino-4 diphenyl-1,1 butene-1 one-3 chlorhydrate [French];3-BUTEN-2-ONE, 1,1-DIPHENYL-4-PIPERIDINO-, HYDROCHLORIDE;Piperidino-4 diphenyl-1,1 butene-1 one-3 chlorhydrate;(E)-1,1-diphenyl-4-piperidin-1-ium-1-ylbut-3-en-2-one;chloride;LS-47291

Chemical Property of 1,1-Diphenyl-4-piperidino-3-buten-2-one hydrochloride

Chemical Property:

• Vapor Pressure: 1.46E-08mmHg at 25°C
• Boiling Point: 457.7°Cat760mmHg
• Flash Point: 171.7°C
• PSA: 21.51000
• Density: g/cm³
• LogP: 1.54330
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 341.1546421
• Heavy Atom Count: 24
• Complexity: 367

Purity/Quality:

1,1-DIPHENYL-4-PIPERIDINO-3-BUTEN-2-ONE HYDROCHLORIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC[NH+](CC1)C=CC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]
• Isomeric SMILES: C1CC[NH+](CC1)/C=C/C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

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