alpha-(p-Aminophenyl)cinnamic acid 3-tropanyl ester hydrochloride hydrate (4:5)

Base Information

• Chemical Name: alpha-(p-Aminophenyl)cinnamic acid 3-tropanyl ester hydrochloride hydrate (4:5)
• CAS No.: 100908-71-2
• Molecular Formula: C23H26 N2 O2 . Cl H
• Molecular Weight: 398.9257
• Mol file: 100908-71-2.mol

Synonyms:alpha-(p-Aminophenyl)cinnamic acid 3-tropanyl ester hydrochloride hydrate (4:5);100908-71-2;Cinnamic acid, alpha-(p-aminophenyl)-, 3-tropanyl ester, hydrochloride, hydrate (4:5);C23H26N2O2.ClH.5/4H2O;LS-54035;C23-H26-N2-O2.Cl-H.5/4H2-O

Chemical Property of alpha-(p-Aminophenyl)cinnamic acid 3-tropanyl ester hydrochloride hydrate (4:5)

Chemical Property:

• Vapor Pressure: 3.12E-11mmHg at 25°C
• Boiling Point: 527.9°C at 760 mmHg
• Flash Point: 273.1°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 398.1761058
• Heavy Atom Count: 28
• Complexity: 533

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[NH+]1C2CCC1CC(C2)OC(=O)C(=CC3=CC=CC=C3)C4=CC=C(C=C4)N.[Cl-]
• Isomeric SMILES: C[NH+]1C2CCC1CC(C2)OC(=O)/C(=C/C3=CC=CC=C3)/C4=CC=C(C=C4)N.[Cl-]

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