Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, ethyl ester

Base Information

• Chemical Name: Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, ethyl ester
• CAS No.: 122199-02-4
• Molecular Formula: C17H22 Cl N O4
• Molecular Weight: 339.8139
• DSSTox Substance ID: DTXSID00153540
• Wikidata: Q83020478

Synonyms:122199-02-4;Ethyl 2-(4-acetamidobutyryl)-5-chlorohydrocinnamate;Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, ethyl ester;Ethyl 2-(4-(acetylamino)-1-oxobutyl)-5-chlorobenzenepropanoate;SCHEMBL194546;DTXSID00153540;LS-31055;PD160452

Chemical Property of Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, ethyl ester

Chemical Property:

• Vapor Pressure: 2.06E-11mmHg at 25°C
• Boiling Point: 532.3°C at 760 mmHg
• Flash Point: 275.7°C
• Density: 1.168g/cm³
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 10
• Exact Mass: 339.1237359
• Heavy Atom Count: 23
• Complexity: 413

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CCC1=C(C=CC(=C1)Cl)C(=O)CCCNC(=O)C

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