CAS: 142628-54-4; 2,4,6-Trihydroxy-5-(1-(6-(2-Hydroxypropan-2-yl)-4,8A-Dimethyl-1,2,3,4,6,7,8,8A-Octahydronaphthalen-1-yl)-3-Methylbutyl)Isophthalaldehyde

• 英文名称2,4,6-Trihydroxy-5-(1-(6-(2-Hydroxypropan-2-yl)-4,8A-Dimethyl-1,2,3,4,6,7,8,8A-Octahydronaphthalen-1-yl)-3-Methylbutyl)Isophthalaldehyde
• 中文名称大果桉醛 E
• IUPAC名称2,4,6-trihydroxy-5-(1-(6-(2-hydroxypropan-2-yl)-4,8a-dimethyl-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl)-3-methylbutyl)isophthalaldehyde
• 其它别名Macrocarpal E; 1,3-Benzenedicarboxaldehyde,2,4,6-Trihydroxy-5-[3-Methyl-1-[1,2,3,4,6,7,8,8A-Octahydro-6-(1-Hydroxy-1-Methylethyl)-4,8A-Dimethyl-1-Naphthalenyl]Butyl]-; 1,3-Benzenedicarboxaldehyde, 2,4,6-Trihydroxy-5-[(1R)-3-Methyl-1-[(1R,4R,6S,8Ar)-1,2,3,4,6,7,8,8A-Octahydro-6-(1-Hydroxy-1-Methylethyl)-4,8A-Dimethyl-1-Naphthalenyl]Butyl]-; 2,4,6-Trihydroxy-5-[1-[6-(2-Hydroxypropan-2-Yl)-4,8A-Dimethyl-2,3,4,6,7,8-Hexahydro-1H-Naphthalen-1-Yl]-3-Methylbutyl]Benzene-1,3-Dicarbaldehyde
• CAS编号142628-54-4
• MFCD编号:MFCD20261012
• 分子式:C28H40O6分子量:472.62
• 产品CID: 651378
• 产品分类天然产物 → 倍半萜

• 相似结构搜索
• 产品信息参考
• InChIKey: XJNGQIYBMXBCRU-UHFFFAOYNA-N
• InChI=1S/C28H40O6/c1-15(2)11-18(23-25(32)19(13-29)24(31)20(14-30)26(23)33)21-8-7-16(3)22-12-17(27(4,5)34)9-10-28(21,22)6/h12-18,21,31-34H,7-11H2,1-6H3
• 计算化学: 氢键受体数6.0氢键供体数4.0可旋转键数7.0

物理性质

• 沸点552.0±50.0 °C at 760 mmHg
• 闪点301.7±26.6 °C
• 密度1.2±0.1 g/cm3
• PSA:115.06
• LogP:9.11
• 折射率1.588
• 蒸汽压0.0±1.6 mmHg at 25°C
• 溶解性Soluble In Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,Etc.
• 外观形态黄色粉末
• 储存条件2-8°C，干燥环境，密闭
• 产品应用该化合物是一种强大的抗菌剂.

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
• 危险品标志Xi
• 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
  2902600000-乙苯
  2902700000-异丙基苯
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• 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