(1S,2R)-2-Dimethylamino-1-Phenylpropan-1-Ol, 1,1-Dioxo-1,2-Benzothiazol-3-One
[CAS# 75011-63-1]

Identification

• Name: (1S,2R)-2-Dimethylamino-1-Phenylpropan-1-Ol, 1,1-Dioxo-1,2-Benzothiazol-3-One
• Synonyms: (1S,2R)-2-Dimethylamino-1-Phenyl-Propan-1-Ol; 1,1-Dioxo-1,2-Benzothiazol-3-One; 1,1-Diketo-1,2-Benzothiazol-3-One; (1S,2R)-2-Dimethylamino-1-Phenyl-Propan-1-Ol; 1,2-Benzisothiazol-3(2H)-One, 1,1-Dioxide, Compd. With (Alphas)-Rel-Alpha-((1R)-1-(Dimethylamino)Ethyl)Benzenemethanol (1:1)
• Molecular Formula: C₁₈H₂₂N₂O₄S
• Molecular Weight: 362.44
• CAS Registry Number: 75011-63-1
• SMILES: [C@H](O)(C1=CC=CC=C1)[C@H](N(C)C)C.C2=CC=CC3=C2[S](=O)(=O)NC3=O
• InChI: 1S/C11H17NO.C7H5NO3S/c1-9(12(2)3)11(13)10-7-5-4-6-8-10;9-7-5-3-1-2-4-6(5)12(10,11)8-7/h4-9,11,13H,1-3H3;1-4H,(H,8,9)/t9-,11-;/m1./s1
• InChIKey: OJKNEDBDODVMFW-FOKYBFFNSA-N

Properties

• Boiling point: 251.3°C at 760 mmHg (Cal.)
• Flash point: 96.9°C (Cal.)