2-[4-(3-Chlorophenyl)piperazin-1-yl]ethyl 3-oxobutanoate

Base Information

• Chemical Name: 2-[4-(3-Chlorophenyl)piperazin-1-yl]ethyl 3-oxobutanoate
• CAS No.: 90096-19-8
• Molecular Formula: C₁₆H₂₁ClN₂O₃
• Molecular Weight: 324.807
• DSSTox Substance ID: DTXSID80600840
• Wikidata: Q82497132

Synonyms:90096-19-8;2-[4-(3-Chlorophenyl)piperazin-1-yl]ethyl 3-oxobutanoate;SCHEMBL7282947;DTXSID80600840;ZZBUJGAZPOHFJB-UHFFFAOYSA-N;2-[4-(3-chlorophenyl)-1-piperazinyl]ethyl acetoacetate

Chemical Property of 2-[4-(3-Chlorophenyl)piperazin-1-yl]ethyl 3-oxobutanoate

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 324.1240702
• Heavy Atom Count: 22
• Complexity: 384

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MSDS Files:

Useful:

• Canonical SMILES: CC(=O)CC(=O)OCCN1CCN(CC1)C2=CC(=CC=C2)Cl

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