(+-)-4-(3-Methoxyphenyl)-3-(dimethylaminomethyl)thiacyclohexen-4-ol S-oxide hydrochloride

Base Information

• Chemical Name: (+-)-4-(3-Methoxyphenyl)-3-(dimethylaminomethyl)thiacyclohexen-4-ol S-oxide hydrochloride
• CAS No.: 119558-27-9
• Molecular Formula: C15H23 N O3 S . Cl H
• Molecular Weight: 333.874
• DSSTox Substance ID: DTXSID00923003
• Mol file: 119558-27-9.mol

Synonyms:(+-)-4-(3-Methoxyphenyl)-3-(dimethylaminomethyl)thiacyclohexen-4-ol S-oxide hydrochloride;119558-27-9;2H-Thiopyran-4-ol, tetrahydro-3-((dimethylamino)methyl)-4-(3-methoxyphenyl)-, 1-oxide, hydrochloride, (3-alpha,4-beta)- (+-)-;C15H23NO3S.ClH;DTXSID00923003;C15-H23-N-O3-S.Cl-H;LS-153317;3-[(Dimethylamino)methyl]-4-hydroxy-4-(3-methoxyphenyl)-1lambda~4~-thian-1-one--hydrogen chloride (1/1)

Chemical Property of (+-)-4-(3-Methoxyphenyl)-3-(dimethylaminomethyl)thiacyclohexen-4-ol S-oxide hydrochloride

Chemical Property:

• Vapor Pressure: 4.99E-11mmHg at 25°C
• Boiling Point: 505.2°Cat760mmHg
• Flash Point: 259.3°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 333.1165425
• Heavy Atom Count: 21
• Complexity: 350

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CC1CS(=O)CCC1(C2=CC(=CC=C2)OC)O.Cl
• Isomeric SMILES: CN(C)C[C@H]1CS(=O)CC[C@]1(C2=CC(=CC=C2)OC)O.Cl