N-[2-[Bis(3-Amino-3-Oxopropyl)Amino]Ethyl]-N-[2-(Stearoylamino)Ethyl]Stearamide Monoacetate
[CAS# 68214-52-8]

Identification

• Name: N-[2-[Bis(3-Amino-3-Oxopropyl)Amino]Ethyl]-N-[2-(Stearoylamino)Ethyl]Stearamide Monoacetate
• Synonyms: Acetic Acid; N-[2-[Bis(3-Amino-3-Oxo-Propyl)Amino]Ethyl]-N-[2-(Octadecanoylamino)Ethyl]Octadecanamide; Acetic Acid; N-[2-[Bis(3-Amino-3-Oxopropyl)Amino]Ethyl]-N-[2-(1-Oxooctadecylamino)Ethyl]Octadecanamide; Acetic Acid; N-[2-[Bis(3-Amino-3-Keto-Propyl)Amino]Ethyl]-N-(2-Stearamidoethyl)Stearamide
• Molecular Formula: C₄₈H₉₅N₅O₆
• Molecular Weight: 838.31
• CAS Registry Number: 68214-52-8
• EINECS: 269-296-9
• SMILES: C(N(C(=O)CCCCCCCCCCCCCCCCC)CCNC(=O)CCCCCCCCCCCCCCCCC)CN(CCC(=O)N)CCC(=O)N.CC(=O)O
• InChI: 1S/C46H91N5O4.C2H4O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-45(54)49-37-40-51(42-41-50(38-35-43(47)52)39-36-44(48)53)46(55)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-2(3)4/h3-42H2,1-2H3,(H2,47,52)(H2,48,53)(H,49,54);1H3,(H,3,4)
• InChIKey: BEGABRDNXCRDEU-UHFFFAOYSA-N

Properties

• Boiling point: 904.4°C at 760 mmHg (Cal.)
• Flash point: 500.8°C (Cal.)