CAS: 1223097-20-8; ((3S,4R,6S)-6-(5,7-Dihydroxy-2-(4-Hydroxyphenyl)-4-Oxo-4H-Chromen-6-yl)-3,4,5-Trihydroxytetrahydro-2H-Pyran-2-yl)Methyl Acetate

• 英文名称((3S,4R,6S)-6-(5,7-Dihydroxy-2-(4-Hydroxyphenyl)-4-Oxo-4H-Chromen-6-yl)-3,4,5-Trihydroxytetrahydro-2H-Pyran-2-yl)Methyl Acetate
• 中文名称6"-O-乙酰基异牡荆黄素
• IUPAC名称((3S,4R,6S)-6-(5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl acetate
• 其它别名6"-O-Acetylisovitexin; 6"-O-Acetylisovitexin; 4H-1-Benzopyran-4-One, 6-[(2ξ,5ξ)-6-O-Acetyl-β-D-Threo-Hexopyranosyl]-5,7-Dihydroxy-2-(4-Hydroxyphenyl)-; 6-[(2ξ5ξ)-6-O-Acetyl-β-D-Threo-Hexopyranosyl]-57-Dihydroxy-2-(4-Hydroxyphenyl)-4H-1-Benzopyran-4-One/6''-O-Acetylisovitexin; 6''-O-Acetylisovitexin
• CAS编号1223097-20-8
• MFCD编号:MFCD20274958
• 分子式:C23H22O11分子量:474.42
• 产品CID: 319798

• 相似结构搜索
• InChIKey: FNDIFZKJJZQTQL-CBIHESCMSA-N
• InChI=1S/C23H22O11/c1-9(24)32-8-16-19(28)21(30)22(31)23(34-16)18-13(27)7-15-17(20(18)29)12(26)6-14(33-15)10-2-4-11(25)5-3-10/h2-7,16,19,21-23,25,27-31H,8H2,1H3/t16 ,19-,2
• 计算化学: 氢键受体数11.0氢键供体数6.0可旋转键数5.0

物理性质

• 沸点787.9±60.0 °C(预测)
• 闪点274.1±26.4 °C
• 密度1.606±0.06 g/cm3(预测)
• pKa:5.92±0.40(预测)
• PSA:187.12
• LogP:0.6625
• 溶解性Soluble In Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,Etc.
• 外观形态黄色粉末

MSDS等安全信息

• 危险描述H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
• 防范说明P264+P280+P305+P351+P338+P337+P313
• 安全声明H303+H313+H333

合成工艺路线路线简述

海关参考信息

• 2902600000-乙苯
  2905122000-异丙醇
  2905310000-1,2-乙二醇
  2905320000-1,2-丙二醇
• 💡 提示：海关信息按照顺序优先匹配，如需确认的海关信息，请参考相关资料。
• 详情请参考：📖 海关编码查询和海关进出口税则

其他信息查阅

• ➥ 象形图和危险代码
• ➥ 防范代码详解
• ➥ 危险代码说明
• ➥ Globally Harmonized System
• ➥ REACH监管