CAS: 1236285-87-2; (2S,4As,6As,7R,9R,10Ar,10Bs)-2-(Furan-3-yl)-9-Hydroxy-10B-Methyl-4,6-Dioxododecahydro-2H-Benzo[f]Isochromene-7-Carboxylic Acid

• 英文名称(2S,4As,6As,7R,9R,10Ar,10Bs)-2-(Furan-3-yl)-9-Hydroxy-10B-Methyl-4,6-Dioxododecahydro-2H-Benzo[f]Isochromene-7-Carboxylic Acid
• 中文名称黄独素 L
• IUPAC名称(2S,4aS,6aS,7R,9R,10aR,10bS)-2-(furan-3-yl)-9-hydroxy-10b-methyl-4,6-dioxododecahydro-2H-benzo[f]isochromene-7-carboxylic acid
• 其它别名Diosbulbin L; (2S,4As,6As,7R,9R,10Ar,10Bs)-2-(3-Furanyl)Dodecahydro-9-Hydroxy-10B-Methyl-4,6-Dioxo-2H-Naphtho[2,1-C]Pyran-7-Carboxylic Acid; 2H-Naphtho[2,1-C]Pyran-7-Carboxylic Acid, 2-(3-Furanyl)Dodecahydro-9-Hydroxy-10B-Methyl-4,6-Dioxo-, (2S,4As,6As,7R,9R,10Ar,10Bs)-
• CAS编号1236285-87-2
• MFCD编号:MFCD28100626
• 分子式:C19H22O7分子量:362.38
• 产品CID: 341274

• 相似结构搜索
• InChIKey: PESWLPIIHLYDJT-OXIVVSFQSA-N
• InChI=1S/C19H22O7/c1-19-7-15(9-2-3-25-8-9)26-18(24)13(19)6-14(21)16-11(17(22)23)4-10(20)5-12(16)19/h2-3,8,10-13,15-16,20H,4-7H2,1H3,(H,22,23)/t10-,11+,12+,13+,15-,16+,19-
• 计算化学: 氢键受体数7.0氢键供体数2.0可旋转键数2.0

物理性质

• 熔点143-144°C
• 沸点629.5±55.0 °C(预测)
• 闪点334.5±31.5 °C
• 密度1.365±0.06 g/cm3(预测)
• pKa:4.38±0.70(预测)
• PSA:114.04
• LogP:1.9508

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

• 2905122000-异丙醇
  2905399002-1,4-丁二醇
  2909110000-乙醚
  2912110000-甲醛
• 💡 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