4-[Bis[2-[(1-Oxooctadecyl)Amino]Ethyl]Amino]-4-Oxoisocrotonic Acid
[CAS# 94134-72-2]

Identification

• Name: 4-[Bis[2-[(1-Oxooctadecyl)Amino]Ethyl]Amino]-4-Oxoisocrotonic Acid
• Synonyms: (Z)-4-[Bis[2-(Octadecanoylamino)Ethyl]Amino]-4-Oxo-But-2-Enoic Acid; (Z)-4-[Bis[2-(1-Oxooctadecylamino)Ethyl]Amino]-4-Oxobut-2-Enoic Acid; (Z)-4-(Bis(2-Stearamidoethyl)Amino)-4-Keto-But-2-Enoic Acid
• Molecular Formula: C₄₄H₈₃N₃O₅
• Molecular Weight: 734.16
• CAS Registry Number: 94134-72-2
• EINECS: 302-841-1
• SMILES: C(N(C(=O)\C=C/C(=O)O)CCNC(=O)CCCCCCCCCCCCCCCCC)CNC(=O)CCCCCCCCCCCCCCCCC
• InChI: 1S/C44H83N3O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(48)45-37-39-47(43(50)35-36-44(51)52)40-38-46-42(49)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36H,3-34,37-40H2,1-2H3,(H,45,48)(H,46,49)(H,51,52)/b36-35-
• InChIKey: CPSMCDQRTMYVMW-KXYMVQBMSA-N

Properties

• Density: 0.967g/cm³ (Cal.)
• Boiling point: 873.828°C at 760 mmHg (Cal.)
• Flash point: 482.274°C (Cal.)