Nipecotic acid, 1-methyl-4-phenyl-, propyl ester, hydrobromide, (E)-(+-)-

Base Information

• Chemical Name: Nipecotic acid, 1-methyl-4-phenyl-, propyl ester, hydrobromide, (E)-(+-)-
• CAS No.: 57153-00-1
• Molecular Formula: C16H24BrNO2
• Molecular Weight: 342.2713
• DSSTox Substance ID: DTXSID70205787

Synonyms:Nipecotic acid, 1-methyl-4-phenyl-, propyl ester, hydrobromide, (E)-(+-)-;Propyl (E)-(+-)-1-methyl-4-phenylnipecotate hydrobromide;3-Piperidinecarboxylic acid, 1-methyl-4-phenyl-, propyl ester, hydrobromide, trans-(+-)-;57153-00-1;C16H23NO2.BrH;DTXSID70205787;LS-96702

Chemical Property of Nipecotic acid, 1-methyl-4-phenyl-, propyl ester, hydrobromide, (E)-(+-)-

Chemical Property:

• Vapor Pressure: 5.11E-05mmHg at 25°C
• Boiling Point: 348.2°C at 760 mmHg
• Flash Point: 115.3°C
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 341.09904
• Heavy Atom Count: 20
• Complexity: 287

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCOC(=O)C1CN(CCC1C2=CC=CC=C2)C.Br
• Isomeric SMILES: CCCOC(=O)[C@H]1CN(CC[C@@H]1C2=CC=CC=C2)C.Br

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