CAS: 3650-31-5; (E)-5-(5-Hydroxy-3-Methylpent-3-En-1-yl)-1,4A-Dimethyl-6-Methylenedecahydronaphthalene-1-Carbaldehyde

• 英文名称(E)-5-(5-Hydroxy-3-Methylpent-3-En-1-yl)-1,4A-Dimethyl-6-Methylenedecahydronaphthalene-1-Carbaldehyde
• 中文名称(E)-5-(5-羟基-3-甲基戊-3-烯-1-基)-1,4A-二甲基-6-亚甲基十氢萘-1-甲醛
• IUPAC名称(E)-5-(5-hydroxy-3-methylpent-3-en-1-yl)-1,4a-dimethyl-6-methylenedecahydronaphthalene-1-carbaldehyde
• 其它别名(13E)-15-Hydroxy-8(17),13-Labdadiene-19-Al; (13E)-15-Hydroxylabda-8(17),13-Dien-19-Al; (1S,8Aα)-Decahydro-5β-[(E)-5-Hydroxy-3-Methyl-3-Pentenyl]-1,4Aβ-Dimethyl-6-Methylene-1β-Naphthalenecarbaldehyde; Agatholal; Contortolal; 1-Naphthalenecarboxaldehyde, Decahydro-5-[(3E)-5-Hydroxy-3-Methyl-3-Penten-1-Yl]-1,4A-Dimethyl-6-Methylene-, (1S,4Ar,5S,8Ar)-
• CAS编号3650-31-5
• MFCD编号:MFCD20260828
• 分子式:C20H32O2分子量:304.47
• 产品CID: 1374406
• 产品分类天然产物 → 萜类

• 相似结构搜索
• 产品信息参考;;;;
• InChIKey: FSLWKIHHQUNBQK-XNTDXEJSSA-N
• InChI=1S/C20H32O2/c1-15(10-13-21)6-8-17-16(2)7-9-18-19(3,14-22)11-5-12-20(17,18)4/h10,14,17-18,21H,2,5-9,11-13H2,1,3-4H3/b15-10+
• 计算化学: 氢键受体数2.0氢键供体数1.0可旋转键数5.0

物理性质

• 沸点409.7±38.0 °C(预测)
• 闪点174.9±19.4 °C
• 密度0.99±0.1 g/cm3(预测)
• pKa:14.44±0.10(预测)
• PSA:37.3
• LogP:4.683
• 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H303 May be harmful if swallowed+H313 Skin contact may be harmful+H333 Inhalation 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
  2912110000-甲醛
  2912120000-乙醛
• 💡 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