4-(4-Chlorobenzyl)-2-(1-Methyl-4-Azepanyl)-1(2H)-Phthalazinone Hydrochloride (1:1)
[CAS# 153408-28-7]

Identification

• Name: 4-(4-Chlorobenzyl)-2-(1-Methyl-4-Azepanyl)-1(2H)-Phthalazinone Hydrochloride (1:1)
• Synonyms: (R)-Azelastine Hydrochloride; (S)-Azelastine Hydrochloride; 1(2H)-Phthalazinone, 4-((4-chlorophenyl)methyl)-2-(hexahydro-1-methyl-1H-azepin-4-yl)-, monohydrochloride
• Molecular Formula: C₂₂H₂₅Cl₂N₃O
• Molecular Weight: 418.36
• CAS Registry Number: 153408-28-7
• SMILES: CN1CCCC(CC1)N2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=C(C=C4)Cl.Cl
• InChI: 1S/C22H24ClN3O.ClH/c1-25-13-4-5-18(12-14-25)26-22(27)20-7-3-2-6-19(20)21(24-26)15-16-8-10-17(23)11-9-16;/h2-3,6-11,18H,4-5,12-15H2,1H3;1H
• InChIKey: YEJAJYAHJQIWNU-UHFFFAOYSA-N

Properties

• Melting point: 226°C (Expl.)
• Refractive index: (Cal.)

Safety Data

• Safety Description: Handle with caution.