CAS: 1159579-45-9; 2-((1R,3Ar,3Bs,5Ar,8R,10Bs,12Ar,13S)-1-Isopropyl-3B,7,7,10B,12A,13-Hexamethyl-6-Oxo-2,3,3A,3B,4,5,6,7,8,9,10B,11,12,12A-Tetradecahydro-1H-5A,8-Methanocyclohepta[a]Cyclopenta[f]Naphthalen-13-yl)Acetic Acid

• 英文名称2-((1R,3Ar,3Bs,5Ar,8R,10Bs,12Ar,13S)-1-Isopropyl-3B,7,7,10B,12A,13-Hexamethyl-6-Oxo-2,3,3A,3B,4,5,6,7,8,9,10B,11,12,12A-Tetradecahydro-1H-5A,8-Methanocyclohepta[a]Cyclopenta[f]Naphthalen-13-yl)Acetic Acid
• 中文名称2-((1R,3AR,3BS,5AR,8R,10BS,12AR,13S)-1-异丙基-3B,7,7,10B,12A,13-六甲基-6-氧代-2,3,3A,3B,4,5,6,7,8,9,10B,11,12,12A-四十氢-1H-5A,8-亚甲基环庚[A]H[F]萘-13-基)基羧酸
• IUPAC名称2-((1R,3aR,3bS,5aR,8R,10bS,12aR,13S)-1-isopropyl-3b,7,7,10b,12a,13-hexamethyl-6-oxo-2,3,3a,3b,4,5,6,7,8,9,10b,11,12,12a-tetradecahydro-1H-5a,8-methanocyclohepta[a]cyclopenta[f]naphthalen-13-yl)acetic acid
• 其它别名Alstonic Acid B; 1H-5A,8-Methanocyclohepta[a]Cyclopenta[f]Naphthalene-13-Acetic Acid, 2,3,3A,3B,4,5,6,7,8,9,10B,11,12,12A-Tetradecahydro-3B,7,7,10B,12A,13-Hexamethyl-1-(1-Methylethyl)-6-Oxo-, (1R,3Ar,3Bs,5Ar,8R,10Bs,12Ar,13S)-
• CAS编号1159579-45-9
• MFCD编号:MFCD20260401
• 分子式:C30H46O3分子量:454.7
• 产品CID: 200616

• 相似结构搜索
• InChIKey: WPCBXRKYKJHHMS-ALFWALAGSA-N
• InChI=1S/C30H46O3/c1-18(2)19-9-10-21-26(19,5)13-14-28(7)22-12-11-20-25(3,4)24(33)30(22,16-15-27(21,28)6)29(20,8)17-23(31)32/h12,18-21H,9-11,13-17H2,1-8H3,(H,31,32)/t19-,2
• 计算化学: 氢键受体数3.0氢键供体数1.0可旋转键数3.0

物理性质

• 沸点555.4±23.0 °C at 760 mmHg
• 闪点303.8±19.1 °C
• 密度1.1±0.1 g/cm3
• PSA:54.37
• LogP:7.2977
• 溶解性Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
• 外观形态粉末

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

• 2901210000-乙烯
  2901220000-丙烯
  2905121000-正丙醇
  2905130000-正丁醇
• 💡 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