2-{2,5-Bis[(²H₃)methyloxy]-4-(propylsulfanyl)phenyl}ethanamine hydrochloride (1:1)
[CAS# 951400-19-4]

Identification

• Name: 2-{2,5-Bis[(²H₃)methyloxy]-4-(propylsulfanyl)phenyl}ethanamine hydrochloride (1:1)
• Synonyms: 2,5-(Dimethoxy-d6)-4-(propylsulfanyl)phenethylamine Hydrochloride
• Molecular Formula: C₁₃H₁₆D₆ClNO₂S
• Molecular Weight: 297.87
• CAS Registry Number: 951400-19-4
• SMILES: Cl.[2H]C([2H])([2H])Oc1cc(SCCC)c(OC([2H])([2H])[2H])cc1CCN
• InChI: 1S/C13H21NO2S.ClH/c1-4-7-17-13-9-11(15-2)10(5-6-14)8-12(13)16-3;/h8-9H,4-7,14H2,1-3H3;1H/i2D3,3D3
• InChIKey: AHZKNSBEESCMGM-HVTBMTIBSA-N

Properties

• Boiling point: 405.9°C at 760 mmHg (Cal.)
• Flash point: 199.3°C (Cal.)
• Refractive index: (Cal.)