Quinine Salicylate
[CAS# 750-90-3]

Identification

• Name: Quinine Salicylate
• Synonyms: 2-Hydroxybenzoic Acid; (R)-(6-Methoxy-4-Quinolyl)-[(2S,4S,5R)-5-Vinylquinuclidin-2-Yl]Methanol; 2-Hydroxybenzoic Acid; (R)-(6-Methoxy-4-Quinolyl)-[(2S,4S,5R)-5-Vinyl-2-Quinuclidinyl]Methanol; (R)-(6-Methoxy-4-Quinolyl)-[(2S,4S,5R)-5-Vinylquinuclidin-2-Yl]Methanol; Salicylic Acid
• Molecular Formula: C₂₇H₃₀N₂O₅
• Molecular Weight: 462.54
• CAS Registry Number: 750-90-3
• EINECS: 212-027-7
• SMILES: [C@H]12C[C@H](N(C[C@@H]1C=C)CC2)[C@H](O)C3=C4C(=NC=C3)C=CC(=C4)OC.C5=C(C(=CC=C5)O)C(O)=O
• InChI: 1S/C20H24N2O2.C7H6O3/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;8-6-4-2-1-3-5(6)7(9)10/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;1-4,8H,(H,9,10)/t13-,14-,19-,20+;/m0./s1
• InChIKey: MAYUSTFJKJSJNC-DSXUQNDKSA-N

Properties

• Boiling point: 495.9°C at 760 mmHg (Cal.)
• Flash point: 253.7°C (Cal.)