1,3-Bis(Hexadecanoylamino)Propan-2-Yl 2-(Phenylmethoxycarbonylamino)Acetate
[CAS# 138404-99-6]

Identification

• Name: 1,3-Bis(Hexadecanoylamino)Propan-2-Yl 2-(Phenylmethoxycarbonylamino)Acetate
• Synonyms: [2-(Hexadecanoylamino)-1-[(Hexadecanoylamino)Methyl]Ethyl] 2-(Phenylmethoxycarbonylamino)Acetate; 2-[[Oxo-(Phenylmethoxy)Methyl]Amino]Acetic Acid [2-(1-Oxohexadecylamino)-1-[(1-Oxohexadecylamino)Methyl]Ethyl] Ester; 2-(Benzyloxycarbonylamino)Acetic Acid [2-Palmitamido-1-(Palmitamidomethyl)Ethyl] Ester
• Molecular Formula: C₄₅H₇₉N₃O₆
• Molecular Weight: 758.14
• CAS Registry Number: 138404-99-6
• SMILES: C1=C(COC(=O)NCC(OC(CNC(=O)CCCCCCCCCCCCCCC)CNC(=O)CCCCCCCCCCCCCCC)=O)C=CC=C1
• InChI: 1S/C45H79N3O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-30-34-42(49)46-36-41(54-44(51)38-48-45(52)53-39-40-32-28-27-29-33-40)37-47-43(50)35-31-26-24-22-20-18-16-14-12-10-8-6-4-2/h27-29,32-33,41H,3-26,30-31,34-39H2,1-2H3,(H,46,49)(H,47,50)(H,48,52)
• InChIKey: PWINRWLNDIBUCE-UHFFFAOYSA-N

Properties

• Density: 0.996g/cm³ (Cal.)
• Boiling point: 866.887°C at 760 mmHg (Cal.)
• Flash point: 478.076°C (Cal.)