Despa-Kowa
[CAS# 82824-05-3]

Identification

• Name: Despa-Kowa
• Synonyms: (1E)-2-[6-[[Amino-[[Amino-[(4-Chlorophenyl)Amino]Methylene]Amino]Methylene]Amino]Hexyl]-1-[Amino-[(4-Chlorophenyl)Amino]Methylene]Guanidine; 2-Benzhydryloxy-N,N-Dimethyl-Ethanamine; [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-10,13-Dimethyl-3-Oxo-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Acetate; 2-Hydroxybenzoic Acid; Acetic Acid [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-10,13-Dimethyl-3-Oxo-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Ester; (1E)-2-[6-[[Amino-[[Amino-[(4-Chlorophenyl)Amino]Methylene]Amino]Methylene]Amino]Hexyl]-1-[Amino-[(4-Chlorophenyl)Amino]Methylene]Guanidine
• Molecular Formula: C₆₉H₈₉Cl₂N₁₁O₁₀
• Molecular Weight: 1303.44
• CAS Registry Number: 82824-05-3
• SMILES: [C@]34([C@H]([C@H]2[C@@H]([C@@]1(C(=CC(=O)CC1)CC2)C)[C@@H](O)C3)CC[C@]4(O)C(=O)COC(=O)C)C.C6=C(NC(=NC(=NCCCCCCN=C(N)N=C(NC5=CC=C(Cl)C=C5)N)N)N)C=CC(=C6)Cl.C(OC(C7=CC=CC=C7)C8=CC=CC=C8)CN(C)C.O=C(O)C9=CC=CC=C9O
• InChI: 1S/C23H32O6.C22H30Cl2N10.C17H21NO.C7H6O3/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3;23-15-5-9-17(10-6-15)31-21(27)33-19(25)29-13-3-1-2-4-14-30-20(26)34-22(28)32-18-11-7-16(24)8-12-18;1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16;8-6-4-2-1-3-5(6)7(9)10/h10,16-18,20,26,28H,4-9,11-12H2,1-3H3;5-12H,1-4,13-14H2,(H5,25,27,29,31,33)(H5,26,28,30,32,34);3-12,17H,13-14H2,1-2H3;1-4,8H,(H,9,10)/t16-,17-,18-,20+,21-,22-,23-;;;/m0.../s1
• InChIKey: WTBFFOHEVHCHBM-KWIXAIMESA-N

Properties

• Boiling point: 699.3°C at 760 mmHg (Cal.)
• Flash point: 376.7°C (Cal.)