Loxapine
[CAS# 1977-10-2]

Identification

• Classification: API >> Nervous system medication >> Antipsychotic
• Name: Loxapine
• Synonyms: 8-Chloro-6-(4-Methyl-1-Piperazinyl)Benzo[B][1,5]Benzoxazepine; Hf 3170; Hf3170
• Molecular Formula: C₁₈H₁₈ClN₃O
• Molecular Weight: 327.81
• CAS Registry Number: 1977-10-2
• EINECS: 217-835-3
• SMILES: C1=C(Cl)C=CC2=C1C(=NC3=C(O2)C=CC=C3)N4CCN(CC4)C
• InChI: 1S/C18H18ClN3O/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18/h2-7,12H,8-11H2,1H3
• InChIKey: XJGVXQDUIWGIRW-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 458.6±55.0°C at 760 mmHg (Cal.)
• Flash point: 231.1±31.5°C (Cal.)

References

• (1): Karunakaran A. Kalesh, Haibin Shi, Jingyan Ge and Shao Q. Yao. The use of click chemistry in the emerging field of catalomics, Org. Biomol. Chem., 2010, 8, 1749.