(1S)-1,5-脱水-1-C-[4-氯-3-[(4-乙氧基苯基)甲基]苯基]-D-山梨醇四乙酸酯

• 常用名: (1S)-1,5-脱水-1-C-[4-氯-3-[(4-乙氧基苯基)甲基]苯基]-D-山梨醇四乙酸酯
• 英文名: (1S)-1,5-Anhydro-1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-D-glucitol tetraacetate
• CAS号: 461432-25-7
• 分子量: 577.019
• 密度: 1.29±0.1 g/cm3
• 沸点: 626.8±55.0 °C at 760 mmHg
• 分子式: C₂₉H₃₃ClO₁₀
• 熔点: N/A
• 闪点: 180.7±30.5 °C

名称

• 中文名: (2R,3R,4R,5S,6S)-2-(乙酰氧基甲基)-6-(4-氯-3-(4-乙氧基苄基)苯基)四氢-2H-吡喃-3,4,5-三yl 三乙酸酯
• 英文名: [(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]oxan-2-yl]methyl acetate
• 中文别名: (1S)-1,5-脱水-1-C-[4-氯-3-[(4-乙氧基苯基)甲基]苯基]-D-山梨醇四乙酸酯

物理化学性质

• 密度: 1.29±0.1 g/cm3
• 沸点: 626.8±55.0 °C at 760 mmHg
• 分子式: C₂₉H₃₃ClO₁₀
• 分子量: 577.019
• 闪点: 180.7±30.5 °C
• 精确质量: 576.176208
• PSA: 123.66000
• LogP: 6.10
• InChIKey: DKOQYKRDCDCNOR-ZCCUTQAASA-N
• SMILES: CCOc1ccc(Cc2cc(C3OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C3OC(C)=O)ccc2Cl)cc1
• 蒸汽压: 0.0±1.8 mmHg at 25°C
• 折射率: 1.561
• 储存条件: 室温，干燥
• 水溶解性: Insuluble (7.5E-4 g/L) (25 ºC)

安全信息

• 危害码 (欧洲): Xi

英文别名

• (1s)-1,5-anhydro-1-c-(4-chloro-3-((4-ethoxyphenyl)methyl)phenyl)-d-glucitoltetraacetate
• acetic acid (2R,3R,4R,5S,6S)-3,4,5-triacetoxy-6-[4-chloro-3-(4-ethoxy-benzyl)-phenyl]-tetrahydro-pyran-2-ylmethyl ester
• D-Glucitol, 1,5-anhydro-1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-, tetraacetate, (1S)-
• (2R,3R,4R,5S,6S)-2-(Acetoxymethyl)-6-(4-chloro-3-(4-ethoxybenzyl)phenyl)tetrahydro-2H-pyran-3,4,5-triyl triacetate
• (1S)-2,3,4,6-Tetra-O-acetyl-1,5-anhydro-1-[4-chloro-3-(4-ethoxybenzyl)phenyl]-D-glucitol
• acetic acid (2R,3R,4R,SS,6S)-3,4,5-triacetoxy-6-[4-chloro-3-{4-ethoxy-benzyl}-phenyl]-tetrahydro-pyran-2-ylmethyl ester
• Dapagliflozin-A3
• (1S)-1,5-Anhydro-1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-D-glucitol tetraacetate