1,1-Diphenyl-4-(1-pyrrolidinyl)-3-buten-2-one hydrochloride

Base Information

• Chemical Name: 1,1-Diphenyl-4-(1-pyrrolidinyl)-3-buten-2-one hydrochloride
• CAS No.: 100482-65-3
• Molecular Formula: C20H21 N O . Cl H
• Molecular Weight: 0
• Mol file: 100482-65-3.mol

Synonyms:1,1-Diphenyl-4-(1-pyrrolidinyl)-3-buten-2-one hydrochloride;100482-65-3;3-BUTEN-2-ONE, 1,1-DIPHENYL-4-(1-PYRROLIDINYL)-, HYDROCHLORIDE;(E)-1,1-diphenyl-4-pyrrolidin-1-ium-1-ylbut-3-en-2-one;chloride;LS-47293

Chemical Property of 1,1-Diphenyl-4-(1-pyrrolidinyl)-3-buten-2-one hydrochloride

Chemical Property:

• Vapor Pressure: 4.46E-08mmHg at 25°C
• Boiling Point: 443.9°C at 760 mmHg
• Flash Point: 167.8°C
• PSA: 20.31000
• LogP: 4.73700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 327.1389920
• Heavy Atom Count: 23
• Complexity: 353

Purity/Quality:

1,1-DIPHENYL-4-(1-PYRROLIDINYL)-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+](C1)C=CC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]
• Isomeric SMILES: C1CC[NH+](C1)/C=C/C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

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