Ethyl 2-(piperazin-1-yl)benzoate

Base Information

• Chemical Name: Ethyl 2-(piperazin-1-yl)benzoate
• CAS No.: 180417-98-5
• Molecular Formula: C13H18N2O2
• Molecular Weight: 234.2942
• DSSTox Substance ID: DTXSID50572308
• Wikidata: Q82460609
• Mol file: 180417-98-5.mol

Synonyms:180417-98-5;ethyl 2-(piperazin-1-yl)benzoate;Ethyl2-piperazinobenzoate;2-(1-Piperazinyl)-benzoic acid ethyl ester;ethyl 2-piperazin-1-ylbenzoate;2-(1-PIPERAZINYL)BENZOIC ACID ETHYL ESTER;Benzoic acid, 2-(1-piperazinyl)-, ethyl ester;Ethyl 2-piperazinobenzoate;SCHEMBL6132585;DTXSID50572308;MFCD11519260;AKOS015908998;2-(1-Piperazinyl)-benzoic?acid?ethyl?ester;A3998;EN300-18745956

Chemical Property of Ethyl 2-(piperazin-1-yl)benzoate

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.537
• Boiling Point: 380.723 °C at 760 mmHg
• Flash Point: 184.055 °C
• PSA: 41.57000
• Density: 1.104 g/cm³
• LogP: 1.66670
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 234.136827821
• Heavy Atom Count: 17
• Complexity: 252

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CC=CC=C1N2CCNCC2

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