2H-Thiopyran-4-ol, tetrahydro-4-(3,5-bis(trifluoromethyl)phenyl)-3-((dimethylamino)methyl)-, hydrochloride, trans-(+-)-

Base Information

• Chemical Name: 2H-Thiopyran-4-ol, tetrahydro-4-(3,5-bis(trifluoromethyl)phenyl)-3-((dimethylamino)methyl)-, hydrochloride, trans-(+-)-
• CAS No.: 119558-38-2
• Molecular Formula: C16H20ClF6NOS
• Molecular Weight: 423.8
• DSSTox Substance ID: DTXSID20152494

Synonyms:119558-38-2;2H-Thiopyran-4-ol, tetrahydro-4-(3,5-bis(trifluoromethyl)phenyl)-3-((dimethylamino)methyl)-, hydrochloride, trans-(+-)-;C16H19F6NOS.ClH;DTXSID20152494;C16-H19-F6-N-O-S.Cl-H;LS-153309

Chemical Property of 2H-Thiopyran-4-ol, tetrahydro-4-(3,5-bis(trifluoromethyl)phenyl)-3-((dimethylamino)methyl)-, hydrochloride, trans-(+-)-

Chemical Property:

• Vapor Pressure: 1.6E-05mmHg at 25°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 3
• Exact Mass: 423.0858321
• Heavy Atom Count: 26
• Complexity: 433

Purity/Quality:

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MSDS Files:

Useful:

• Canonical SMILES: CN(C)CC1CSCCC1(C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)O.Cl
• Isomeric SMILES: CN(C)C[C@H]1CSCC[C@]1(C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)O.Cl

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