3-(2-羟基丙-2-基)-6a,12b-二甲基-9-(4-甲基-3-氧代己烷-2-基)-1,2,3,4a,5,6,12,12a-八氢苯并吡喃并[6,5-b]苯并吡喃-8,11-二酮
[CAS# 157183-69-2]

基本信息

• 产品名称: 3-(2-羟基丙-2-基)-6a,12b-二甲基-9-(4-甲基-3-氧代己烷-2-基)-1,2,3,4a,5,6,12,12a-八氢苯并吡喃并[6,5-b]苯并吡喃-8,11-二酮
• 英文名: 3-(2-Hydroxypropan-2-Yl)-6a,12b-Dimethyl-9-(4-Methyl-3-Oxohexan-2-Yl)-1,2,3,4a,5,6,12,12a-Octahydrochromeno[6,5-b]Chromene-8,11-Dione
• 别名: 9-(1,3-Dimethyl-2-Oxo-Pentyl)-3-(1-Hydroxy-1-Methyl-Ethyl)-6A,12B-Dimethyl-1,2,3,4A,5,6,12,12A-Octahydrochromeno[6,5-B]Chromene-8,11-Dione; 9-(1,3-Dimethyl-2-Oxopentyl)-3-(1-Hydroxy-1-Methylethyl)-6A,12B-Dimethyl-1,2,3,4A,5,6,12,12A-Octahydrochromeno[6,5-B]Chromene-8,11-Dione; 3-(1-Hydroxy-1-Methyl-Ethyl)-9-(2-Keto-1,3-Dimethyl-Pentyl)-6A,12B-Dimethyl-1,2,3,4A,5,6,12,12A-Octahydrochromeno[6,5-B]Chromene-8,11-Quinone
• 分子式: C₂₈H₄₀O₆
• 分子量: 472.62
• CAS 登录号: 157183-69-2
• 分子行输入简码 SMILES: C(C(C(=O)C(C4=CC(=O)C3=C(OC2(C(C1(C(OC(CC1)C(O)(C)C)CC2)C)C3)C)C4=O)C)C)C
• 国际化学标识码 InChI: 1S/C28H40O6/c1-8-15(2)23(30)16(3)17-13-19(29)18-14-20-27(6)11-9-21(26(4,5)32)33-22(27)10-12-28(20,7)34-25(18)24(17)31/h13,15-16,20-22,32H,8-12,14H2,1-7H3
• 国际化学标识检索码 InChIKey: NTPNSKLZWVYKGK-UHFFFAOYSA-N

物理化学性质

• 密度: 1.175g/cm³ （计算值）
• 沸点: 579.359°C at 760 mmHg （计算值）
• 闪点: 184.184°C （计算值）