Convolamine hydrochloride

Base Information

• Chemical Name: Convolamine hydrochloride
• CAS No.: 5896-59-3
• Molecular Formula: C17H23NO4
• Molecular Weight: 341.82976
• DSSTox Substance ID: DTXSID60423559
• Mol file: 5896-59-3.mol

Synonyms:Convolamine hydrochloride;5896-59-3;[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 3,4-dimethoxybenzoate;hydrochloride;Prestwick_127;DTXSID60423559;HMS1569H14;1.alpha.H,5.alpha.H-Tropan-3.alpha.-ol, veratrate (ester), hydrochloride;Benzoic acid, 3,4-dimethoxy-, 8-methyl-8-azobicyclo[3.2.1]oct-3-yl ester, hydrochloride, endo-

Chemical Property of Convolamine hydrochloride

Chemical Property:

• Vapor Pressure: 4.08E-07mmHg at 25°C
• Boiling Point: 415.6°C at 760 mmHg
• Flash Point: 205.1°C
• PSA: 48.00000
• Density: 1.19g/cm³
• LogP: 3.22570
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 341.1393859
• Heavy Atom Count: 23
• Complexity: 388

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2CCC1CC(C2)OC(=O)C3=CC(=C(C=C3)OC)OC.Cl
• Isomeric SMILES: CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)C3=CC(=C(C=C3)OC)OC.Cl