叔丁基2-[(3R,6S,9S,15S,18S,21S,24S,27S,30S)-15,18-二[(2S)-丁烷-2-基]-6-[(4-甲氧基苯基)甲基]-3,10,16,19,22,28-六甲基-2,5,8,11,14,17,20,23,26,29-十氧代-9,24,27-三(丙-2-基)-4-氧杂-1,7,10,13,16,19,22,25,28-九氮杂双环[28.4.0]三十四烷-21-基]乙酸酯
[CAS# 129893-84-1]

基本信息

• 产品名称: 叔丁基2-[(3R,6S,9S,15S,18S,21S,24S,27S,30S)-15,18-二[(2S)-丁烷-2-基]-6-[(4-甲氧基苯基)甲基]-3,10,16,19,22,28-六甲基-2,5,8,11,14,17,20,23,26,29-十氧代-9,24,27-三(丙-2-基)-4-氧杂-1,7,10,13,16,19,22,25,28-九氮杂双环[28.4.0]三十四烷-21-基]乙酸酯
• 英文名: Tert-Butyl 2-[(3R,6S,9S,15S,18S,21S,24S,27S,30S)-15,18-Bis[(2S)-Butan-2-Yl]-6-[(4-Methoxyphenyl)Methyl]-3,10,16,19,22,28-Hexamethyl-2,5,8,11,14,17,20,23,26,29-Decaoxo-9,24,27-Tri(Propan-2-Yl)-4-Oxa-1,7,10,13,16,19,22,25,28-Nonazabicyclo[28.4.0]Tetratriacontan-21-Yl]Acetate
• 别名: Tert-Butyl 2-[(3R,6S,9S,15S,18S,21S,24S,27S,30S)-9,24,27-Triisopropyl-6-[(4-Methoxyphenyl)Methyl]-3,10,16,19,22,28-Hexamethyl-2,5,8,11,14,17,20,23,26,29-Decaoxo-15,18-Disec-Butyl-4-Oxa-1,7,10,13,16,19,22,25,28-Nonazabicyclo[28.4.0]Tetratriacontan-21-Yl]Acetate; 2-[(3R,6S,9S,15S,18S,21S,24S,27S,30S)-9,24,27-Triisopropyl-6-[(4-Methoxyphenyl)Methyl]-3,10,16,19,22,28-Hexamethyl-2,5,8,11,14,17,20,23,26,29-Decaoxo-15,18-Disec-Butyl-4-Oxa-1,7,10,13,16,19,22,25,28-Nonazabicyclo[28.4.0]Tetratriacontan-21-Yl]Acetic Acid Tert-Butyl Ester; 2-[(3R,6S,9S,15S,18S,21S,24S,27S,30S)-9,24,27-Triisopropyl-2,5,8,11,14,17,20,23,26,29-Decaketo-6-(4-Methoxybenzyl)-3,10,16,19,22,28-Hexamethyl-15,18-Disec-Butyl-4-Oxa-1,7,10,13,16,19,22,25,28-Nonazabicyclo[28.4.0]Tetratriacontan-21-Yl]Acetic Acid Tert-Butyl Ester
• 分子式: C₆₁H₉₉N₉O₁₄
• 分子量: 1182.51
• CAS 登录号: 129893-84-1
• 分子行输入简码 SMILES: [C@H]1(N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@H]3N(C(=O)[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)CNC(=O)[C@@H](N(C1=O)C)[C@H](CC)C)C)C(C)C)CC2=CC=C(OC)C=C2)C)CCCC3)C)C(C)C)C(C)C)C)CC(OC(C)(C)C)=O)C)[C@H](CC)C
• 国际化学标识码 InChI: 1S/C61H99N9O14/c1-21-37(9)50-52(73)62-33-45(71)66(16)48(35(5)6)53(74)63-42(31-40-26-28-41(82-20)29-27-40)60(81)83-39(11)55(76)70-30-24-23-25-43(70)56(77)67(17)49(36(7)8)54(75)64-47(34(3)4)58(79)65(15)44(32-46(72)84-61(12,13)14)57(78)69(19)51(38(10)22-2)59(80)68(50)18/h26-29,34-39,42-44,47-51H,21-25,30-33H2,1-20H3,(H,62,73)(H,63,74)(H,64,75)/t37-,38-,39+,42-,43-,44-,47-,48-,49-,50-,51-/m0/s1
• 国际化学标识检索码 InChIKey: UGWMRFXIOXUDPM-OUABENRGSA-N

物理化学性质

• 密度: 1.197g/cm³ （计算值）
• 沸点: 1261.959°C at 760 mmHg （计算值）
• 闪点: 717.007°C （计算值）