(2S)-2,6-diamino-N-[(1-tridecanoyl-2-piperidyl)methyl]hexanamide dihydrochloride
[CAS# 141774-20-1]

Identification

• Name: (2S)-2,6-diamino-N-[(1-tridecanoyl-2-piperidyl)methyl]hexanamide dihydrochloride
• Synonyms: (S)-2,6-Diamino-N-[(1-(1-oxotridecyl)-2-piperidinyl)methyl]hexanamide dihydrochloride hydrate; [136449-85-9]; 141774-20-1 (anhydrous)
• Molecular Formula: C₂₅H₅₂Cl₂N₄O₂
• Molecular Weight: 511.61
• CAS Registry Number: 141774-20-1
• SMILES: O=C(N1C(CNC(=O)[C@@H](N)CCCCN)CCCC1)CCCCCCCCCCCC.Cl.Cl
• InChI: 1S/C25H50N4O2.2ClH/c1-2-3-4-5-6-7-8-9-10-11-18-24(30)29-20-15-13-16-22(29)21-28-25(31)23(27)17-12-14-19-26;;/h22-23H,2-21,26-27H2,1H3,(H,28,31);2*1H/t22?,23-;;/m0../s1
• InChIKey: RISSBZWRJRRXTD-OLBPYZPGSA-N

Properties

• Melting point: 180-182°C (Expl.)
• Boiling point: 681.7°C at 760 mmHg (Cal.)
• Flash point: 366.1°C (Cal.)
• Refractive index: (Cal.)