Isoetarine
[CAS# 530-08-5]

Identification

• Name: Isoetarine
• Synonyms: 4-[1-Hydroxy-2-(Isopropylamino)Butyl]Benzene-1,2-Diol; 4-[1-Hydroxy-2-(Isopropylamino)Butyl]Pyrocatechol; 1,2-Benzenediol, 4-[1-Hydroxy-2-[(1-Methylethyl)Amino]Butyl]-
• Molecular Formula: C₁₃H₂₁NO₃
• Molecular Weight: 239.31
• CAS Registry Number: 530-08-5
• EINECS: 208-472-1
• SMILES: C1=C(C(=CC=C1C(C(NC(C)C)CC)O)O)O
• InChI: 1S/C13H21NO3/c1-4-10(14-8(2)3)13(17)9-5-6-11(15)12(16)7-9/h5-8,10,13-17H,4H2,1-3H3
• InChIKey: HUYWAWARQUIQLE-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 429.3±40.0°C at 760 mmHg (Cal.)
• Flash point: 156.7±17.9°C (Cal.)