(+)-3,4-Dihydroxy-alpha-[(Isopropylamino)Methyl]-Benzyl Alcohol Sulfate (2:1) (Salt)
[CAS# 6779-80-2]

Identification

• Name: (+)-3,4-Dihydroxy-alpha-[(Isopropylamino)Methyl]-Benzyl Alcohol Sulfate (2:1) (Salt)
• Synonyms: 4-[1-Hydroxy-2-(Isopropylamino)Ethyl]Benzene-1,2-Diol; Sulfuric Acid; 4-[1-Hydroxy-2-(Isopropylamino)Ethyl]Pyrocatechol; Sulfuric Acid; Aleudrin
• Molecular Formula: C₂₂H₃₆N₂O₁₀S
• Molecular Weight: 520.59
• CAS Registry Number: 6779-80-2
• SMILES: C1=C(C(=CC=C1C(CNC(C)C)O)O)O.C2=C(C(=CC=C2C(CNC(C)C)O)O)O.O=[S](O)(O)=O
• InChI: 1S/2C11H17NO3.H2O4S/c2*1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8;1-5(2,3)4/h2*3-5,7,11-15H,6H2,1-2H3;(H2,1,2,3,4)
• InChIKey: ZOLBALGTFCCTJF-UHFFFAOYSA-N

Properties

• Boiling point: 417.5°C at 760 mmHg (Cal.)
• Flash point: 179.7°C (Cal.)