12-Butan-2-Yl-15-(2-Hydroxypropan-2-Yl)-4,10,16,22-Tetramethyl-18-(2-Methylpropyl)-24-(2-Methylsulfinylethyl)-3,6-Bis(Phenylmethyl)-9,21-Di(Propan-2-Yl)-13-Oxa-1,4,7,10,16,19,22,25-Octazabicyclo[25.3.0]Triacontane-2,5,8,11,14,17,20,23,26-Nonone
[CAS# 153954-71-3]

Identification

• Name: 12-Butan-2-Yl-15-(2-Hydroxypropan-2-Yl)-4,10,16,22-Tetramethyl-18-(2-Methylpropyl)-24-(2-Methylsulfinylethyl)-3,6-Bis(Phenylmethyl)-9,21-Di(Propan-2-Yl)-13-Oxa-1,4,7,10,16,19,22,25-Octazabicyclo[25.3.0]Triacontane-2,5,8,11,14,17,20,23,26-Nonone
• Synonyms: 15-(1-Hydroxy-1-Methyl-Ethyl)-18-Isobutyl-9,21-Diisopropyl-4,10,16,22-Tetramethyl-24-(2-Methylsulfinylethyl)-3,6-Bis(Phenylmethyl)-12-Sec-Butyl-13-Oxa-1,4,7,10,16,19,22,25-Octazabicyclo[25.3.0]Triacontane-2,5,8,11,14,17,20,23,26-Nonone; 15-(1-Hydroxy-1-Methylethyl)-18-Isobutyl-9,21-Diisopropyl-4,10,16,22-Tetramethyl-24-(2-Methylsulfinylethyl)-3,6-Bis(Phenylmethyl)-12-Sec-Butyl-13-Oxa-1,4,7,10,16,19,22,25-Octazabicyclo[25.3.0]Triacontane-2,5,8,11,14,17,20,23,26-Nonone; 3,6-Bis(Benzyl)-15-(1-Hydroxy-1-Methyl-Ethyl)-18-Isobutyl-9,21-Diisopropyl-4,10,16,22-Tetramethyl-24-(2-Methylsulfinylethyl)-12-Sec-Butyl-13-Oxa-1,4,7,10,16,19,22,25-Octazabicyclo[25.3.0]Triacontane-2,5,8,11,14,17,20,23,26-Nonone
• Molecular Formula: C₅₉H₉₀N₈O₁₂S
• Molecular Weight: 1135.47
• CAS Registry Number: 153954-71-3
• SMILES: C4=C(CC1N(C(=O)C(NC(=O)C(N(C(=O)C(OC(=O)C(N(C(=O)C(NC(=O)C(N(C(=O)C(NC(=O)C2N(C1=O)CCC2)CC[S](=O)C)C)C(C)C)CC(C)C)C)C(O)(C)C)C(CC)C)C)C(C)C)CC3=CC=CC=C3)C)C=CC=C4
• InChI: 1S/C59H90N8O12S/c1-16-38(8)48-57(75)65(13)47(37(6)7)52(70)62-43(33-39-24-19-17-20-25-39)54(72)63(11)45(34-40-26-21-18-22-27-40)56(74)67-30-23-28-44(67)50(68)60-41(29-31-80(15)78)53(71)64(12)46(36(4)5)51(69)61-42(32-35(2)3)55(73)66(14)49(58(76)79-48)59(9,10)77/h17-22,24-27,35-38,41-49,77H,16,23,28-34H2,1-15H3,(H,60,68)(H,61,69)(H,62,70)
• InChIKey: LWWLFVPYKYLVRJ-UHFFFAOYSA-N

Properties

• Density: 1.243g/cm³ (Cal.)
• Boiling point: 1297.186°C at 760 mmHg (Cal.)
• Flash point: 738.311°C (Cal.)