3-氯-2-羟基-2-甲基丙酸 [十二氢-8-乙酰氧基-9-羟基-9-(羟基甲基)-3,6-二(亚甲基)-2-氧代薁并[4,5-b]呋喃-4-基]酯
[CAS 66761-10-2]

基本信息

• 产品名称: 3-氯-2-羟基-2-甲基丙酸 [十二氢-8-乙酰氧基-9-羟基-9-(羟基甲基)-3,6-二(亚甲基)-2-氧代薁并[4,5-b]呋喃-4-基]酯
• 英文名: 3-Chloro-2-Hydroxy-2-Methylpropionic Acid [Dodecahydro-8-Acetoxy-9-Hydroxy-9-(Hydroxymethyl)-3,6-Bis(Methylene)-2-Oxoazuleno[4,5-b]Furan-4-Yl] Ester
• 别名: [8-Acetoxy-9-Hydroxy-9-(Hydroxymethyl)-3,6-Dimethylene-2-Oxo-3A,4,5,6A,7,8,9A,9B-Octahydroazuleno[4,5-B]Furan-4-Yl] 3-Chloro-2-Hydroxy-2-Methyl-Propanoate; 3-Chloro-2-Hydroxy-2-Methylpropanoic Acid [8-Acetoxy-9-Hydroxy-9-(Hydroxymethyl)-3,6-Dimethylene-2-Oxo-3A,4,5,6A,7,8,9A,9B-Octahydroazuleno[4,5-B]Furan-4-Yl] Ester; 3-Chloro-2-Hydroxy-2-Methyl-Propionic Acid (8-Acetoxy-9-Hydroxy-2-Keto-3,6-Dimethylene-9-Methylol-3A,4,5,6A,7,8,9A,9B-Octahydroazuleno[5,4-D]Furan-4-Yl) Ester
• 分子式: C₂₁H₂₇ClO₉
• 分子量: 458.89
• CAS 登录号: 66761-10-2
• 分子行输入简码 SMILES: C(O)C1(O)C2C(CC1OC(=O)C)C(CC(OC(=O)C(O)(CCl)C)C3C2OC(=O)C3=C)=C
• 国际化学标识码 InChI: 1S/C21H27ClO9/c1-9-5-13(30-19(26)20(4,27)7-22)15-10(2)18(25)31-17(15)16-12(9)6-14(29-11(3)24)21(16,28)8-23/h12-17,23,27-28H,1-2,5-8H2,3-4H3
• 国际化学标识检索码 InChIKey: BQZOLDKICRHJKZ-UHFFFAOYSA-N

物理化学性质

• 密度: 1.415g/cm³ （计算值）
• 沸点: 641.139°C at 760 mmHg （计算值）
• 闪点: 341.549°C （计算值）