[5-(Azepan-1-Ylmethyl)-1,2,5-Trimethyl-4-Phenyl-4-Piperidyl] 4-Aminobenzoate Dihydrochloride
[CAS# 73816-92-9]

Identification

• Name: [5-(Azepan-1-Ylmethyl)-1,2,5-Trimethyl-4-Phenyl-4-Piperidyl] 4-Aminobenzoate Dihydrochloride
• Synonyms: [5-(Azepan-1-Ylmethyl)-1,2,5-Trimethyl-4-Phenyl-4-Piperidyl] 4-Aminobenzoate Dihydrochloride; 4-Aminobenzoic Acid [5-(1-Azepanylmethyl)-1,2,5-Trimethyl-4-Phenyl-4-Piperidinyl] Ester Dihydrochloride; 4-Aminobenzoic Acid [5-(Azepan-1-Ylmethyl)-1,2,5-Trimethyl-4-Phenyl-4-Piperidyl] Ester Dihydrochloride
• Molecular Formula: C₂₈H₄₁Cl₂N₃O₂
• Molecular Weight: 522.56
• CAS Registry Number: 73816-92-9
• SMILES: [H+].[H+].C(N1CCCCCC1)C4(C(OC(=O)C2=CC=C(N)C=C2)(C3=CC=CC=C3)CC(N(C4)C)C)C.[Cl-].[Cl-]
• InChI: 1S/C28H39N3O2.2ClH/c1-22-19-28(24-11-7-6-8-12-24,33-26(32)23-13-15-25(29)16-14-23)27(2,20-30(22)3)21-31-17-9-4-5-10-18-31;;/h6-8,11-16,22H,4-5,9-10,17-21,29H2,1-3H3;2*1H
• InChIKey: XVZZASNHOPZOHL-UHFFFAOYSA-N

Properties

• Boiling point: 583.6°C at 760 mmHg (Cal.)
• Flash point: 306.7°C (Cal.)