Brasofensine sulfate

Base Information

• Chemical Name: Brasofensine sulfate
• CAS No.: 171655-92-8
• Molecular Formula: C16H22Cl2N2O5S
• Molecular Weight: 425.3273
• Mol file: 171655-92-8.mol

Synonyms:(E)-1R,2R,3S-3-(3,4-dichlorophenyl)-8-methyl-8-azabicyclo(3.2.1)octane-2-carbaldehyde O-methyloxime;BMS 204756;brasofensine;NS2214

Chemical Property of Brasofensine sulfate

Chemical Property:

• Vapor Pressure: 4.7E-07mmHg at 25°C
• Boiling Point: 413.7°Cat760mmHg
• Flash Point: 204°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 424.0626484
• Heavy Atom Count: 26
• Complexity: 474

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2CCC1C(C(C2)C3=CC(=C(C=C3)Cl)Cl)C=NOC.OS(=O)(=O)O
• Isomeric SMILES: CN1[C@@H]2CC[C@@H]1[C@@H]([C@H](C2)C3=CC(=C(C=C3)Cl)Cl)/C=N/OC.OS(=O)(=O)O