2-(3,4-dichlorophenyl)-1-[(2S)-2-(pyrrolidin-1-ylmethyl)piperazin-1-yl]ethanone

Base Information

• Chemical Name: 2-(3,4-dichlorophenyl)-1-[(2S)-2-(pyrrolidin-1-ylmethyl)piperazin-1-yl]ethanone
• CAS No.: 260992-21-0
• Molecular Formula: C17H23Cl2N3O
• Molecular Weight: 356.29000
• DSSTox Substance ID: DTXSID90432679
• Wikidata: Q82246784

Synonyms:260992-21-0;2-(3,4-dichlorophenyl)-1-[(2S)-2-(pyrrolidin-1-ylmethyl)piperazin-1-yl]ethanone;SCHEMBL14367940;DTXSID90432679

Chemical Property of 2-(3,4-dichlorophenyl)-1-[(2S)-2-(pyrrolidin-1-ylmethyl)piperazin-1-yl]ethanone

Chemical Property:

• Boiling Point: 513.4±50.0 °C(Predicted)
• PSA: 35.58000
• Density: 1.259±0.06 g/cm3(Predicted)
• LogP: 2.63670
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 355.1218178
• Heavy Atom Count: 23
• Complexity: 403

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(C1)CC2CNCCN2C(=O)CC3=CC(=C(C=C3)Cl)Cl
• Isomeric SMILES: C1CCN(C1)C[C@@H]2CNCCN2C(=O)CC3=CC(=C(C=C3)Cl)Cl

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