S-Allyl-3-hydroxy-17-thioniamorphinan

Base Information

• Chemical Name: S-Allyl-3-hydroxy-17-thioniamorphinan
• CAS No.: 132958-69-1
• Molecular Formula: C19H25OS+
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID20927881
• Mol file: 132958-69-1.mol

Synonyms:S-allyl-3-hydroxy-17-thioniamorphinan;S-allyl-3-hydroxy-17-thioniamorphinan, (4aalpha,10alpha,10aalpha,11R*)-(+-) isomer;SAHTM

Chemical Property of S-Allyl-3-hydroxy-17-thioniamorphinan

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 0.00000
• Density: g/cm³
• LogP: 0.00000
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 301.16261159
• Heavy Atom Count: 21
• Complexity: 408

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C=CC[S+]1CCC23CCCCC2C1CC4=C3C=C(C=C4)O
• Isomeric SMILES: C=CC[S+]1CCC23CCCC[C@H]2[C@H]1CC4=C3C=C(C=C4)O