(7-Hydroxy-6-Methoxy-1,2,3,4-Tetrahydro-1-Isoquinolinyl)Acetic Acid
[CAS# 111599-06-5]

Identification

• Name: (7-Hydroxy-6-Methoxy-1,2,3,4-Tetrahydro-1-Isoquinolinyl)Acetic Acid
• Synonyms: (7-HYDROXY-6-METHOXY-1,2,3,4-TETRAHYDRO-ISOQUINOLIN-1-YL)-ACETICACID
• Molecular Formula: C₁₂H₁₅NO₄
• Molecular Weight: 237.25
• CAS Registry Number: 111599-06-5
• SMILES: COc1cc2c(cc1O)C(NCC2)CC(=O)O
• InChI: 1S/C12H15NO4/c1-17-11-4-7-2-3-13-9(6-12(15)16)8(7)5-10(11)14/h4-5,9,13-14H,2-3,6H2,1H3,(H,15,16)
• InChIKey: BEFONHIUMKTHKT-UHFFFAOYSA-N

Properties

• Density: 1.269g/cm³ (Cal.)
• Boiling point: 476.598°C at 760 mmHg (Cal.)
• Flash point: 242.038°C (Cal.)
• Refractive index: 1.569 (Cal.)