Piroheptine
[CAS# 16378-21-5]

Identification

• Name: Piroheptine
• Synonyms: Pyrrolidine, 3-(10,11-Dihydro-5H-Dibenzo(A,D)Cyclohepten-5-Ylidene)-1-Ethyl-2-Methyl-, Hydrochloride; Trimol; D01231
• Molecular Formula: C₂₂H₂₆ClN
• Molecular Weight: 339.91
• CAS Registry Number: 16378-21-5 (16378-22-6)
• SMILES: [H+].C4=C3C(=C1C(N(CC1)CC)C)C2=CC=CC=C2CCC3=CC=C4.[Cl-]
• InChI: 1S/C22H25N.ClH/c1-3-23-15-14-19(16(23)2)22-20-10-6-4-8-17(20)12-13-18-9-5-7-11-21(18)22;/h4-11,16H,3,12-15H2,1-2H3;1H
• InChIKey: PLJNHZOEOXGWIR-UHFFFAOYSA-N

Properties

• Boiling point: 434.5°C at 760 mmHg (Cal.)
• Flash point: 191.7°C (Cal.)