8-Butyl-3-hydroxy-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate

Base Information

• Chemical Name: 8-Butyl-3-hydroxy-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate
• CAS No.: 74051-25-5
• Molecular Formula: C22H34BrNO3
• Molecular Weight: 440.4143
• DSSTox Substance ID: DTXSID40995486

Synonyms:8-Butyl-3-hydroxy-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate;1-alpha-H,5-alpha-H-Tropanium, 8-butyl-3-hydroxy-, bromide, 4-hydroxy-2-phenylbutanoate;74051-25-5;DTXSID40995486;LS-157824;8-Azoniabicyclo[3.2.1]octane, 8-butyl-3-(4-hydroxy-1-oxo-2-phenylbutoxy)-8-methyl-, bromide;8-Butyl-3-[(4-hydroxy-2-phenylbutanoyl)oxy]-8-methyl-8-azabicyclo[3.2.1]octan-8-ium bromide

Chemical Property of 8-Butyl-3-hydroxy-1-alpha-H,5-alpha-H-tropanium bromide 4-hydroxy-2-phenylbutanoate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: g/cm³
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 439.17221
• Heavy Atom Count: 27
• Complexity: 446

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC[N+]1(C2CCC1CC(C2)OC(=O)C(CCO)C3=CC=CC=C3)C.[Br-]

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