CAS: 52992-82-2; Methyl (1S,4Ar,5S,8Ar)-5-(5-Acetoxy-3-Methylpent-3-En-1-yl)-4A-Methyl-6-Methylenedecahydronaphthalene-1-Carboxylate

• 英文名称Methyl (1S,4Ar,5S,8Ar)-5-(5-Acetoxy-3-Methylpent-3-En-1-yl)-4A-Methyl-6-Methylenedecahydronaphthalene-1-Carboxylate
• 中文名称乙酰基异柏烯酸
• IUPAC名称methyl (1S,4aR,5S,8aR)-5-(5-acetoxy-3-methylpent-3-en-1-yl)-4a-methyl-6-methylenedecahydronaphthalene-1-carboxylate
• 其它别名Acetylisocupressicacid; (13E)-15-Acetoxy-8(17),13-Labdadiene-19-Oic Acid; (1S,8Aα)-Decahydro-1,4Aβ-Dimethyl-6-Methylene-5β-[(E)-3-Methyl-5-(Acetyloxy)-3-Pentenyl]Naphthalene-1β-Carboxylic Acid; (E)-15-Acetoxy-8(17),13-Labdadiene-19-Oic Acid; 15-Acetoxyisocupressic Acid; Methyl (1S,4As,5R,8Ar)-5-[(E)-5-Acetyloxy-3-Methyl-Pent-3-Enyl]-4A-Methyl-6-Methylidene-Decalin-1-Carboxylate; 1-Naphthalenecarboxylic Acid, 5-[(3E)-5-(Acetyloxy)-3-Methyl-3-Penten-1-Yl]Decahydro-1,4A-Dimethyl-6-Methylene-, (1S,4Ar,5S,8Ar)-
• CAS编号52992-82-2
• MFCD编号:MFCD20260556
• 分子式:C22H34O4分子量:362.51
• 产品CID: 2511862
• 产品分类天然产物 → 萜类

• 相似结构搜索
• InChIKey: MGQMYSVCEMGOPL-KEZQHZCBSA-N
• InChI=1S/C22H34O4/c1-15(12-14-26-17(3)23)8-10-19-16(2)9-11-20-18(21(24)25-5)7-6-13-22(19,20)4/h12,18-20H,2,6-11,13-14H2,1,3-5H3/t18-,19-,20+,22-/m0/s1
• 计算化学: 氢键受体数4.0氢键供体数0.0可旋转键数8.0

物理性质

• 沸点471.4±38.0 °C at 760 mmHg
• 闪点206.4 °C
• 密度3>1.03g/ cm3
• PSA:63.6
• LogP:6.159 (est)
• 蒸汽压8.52E-08 mmHg at 25 °C

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

上下游产品

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
  2909110000-乙醚
• 💡 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