Ethyl 4-[8-chloro-4-(hydroxymethyl)-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene]-1-piperidinecarboxylate
[CAS# 609806-40-8]

Identification

• Name: Ethyl 4-[8-chloro-4-(hydroxymethyl)-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene]-1-piperidinecarboxylate
• Synonyms: 1-Piperidinecarboxylic acid, 4-[8-chloro-5,6-dihydro-4-(hydroxymethyl)-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene]-, ethyl ester; 4-Hydroxymethyl Loratadine
• Molecular Formula: C₂₃H₂₅ClN₂O₃
• Molecular Weight: 412.91
• CAS Registry Number: 609806-40-8
• SMILES: O=C(OCC)N4CC/C(=C2/c1ccc(Cl)cc1CCc3c(ccnc23)CO)CC4
• InChI: 1S/C23H25ClN2O3/c1-2-29-23(28)26-11-8-15(9-12-26)21-19-6-4-18(24)13-16(19)3-5-20-17(14-27)7-10-25-22(20)21/h4,6-7,10,13,27H,2-3,5,8-9,11-12,14H2,1H3
• InChIKey: BCKYTUFUNAGTDV-UHFFFAOYSA-N

Properties

• Density: 1.301g/cm³ (Cal.)
• Boiling point: 594.202°C at 760 mmHg (Cal.)
• Flash point: 313.163°C (Cal.)
• Refractive index: 1.626 (Cal.)