CAS: 26952-21-6; Isooctanol

• 英文名称Isooctanol
• 中文名称6-甲基庚烷-1-醇
• IUPAC名称6-methylheptan-1-ol
• 其它别名Isoocityl Alcohol; Exxal8; Isooctylalcohol(Mixedisomers); Oxooctylalcohol; Isooctan-1-Ol; Isooctyl Alcolol
• CAS编号26952-21-6
• MFCD编号:MFCD00060842
• EINECS号:248-133-5
• 分子式:C48H57FeP3
• 分子量:130.22792
• 产品CID: 1249186
• 产品分类有机原料→通用试剂→有机通用试剂

• 相似结构搜索
• 产品信息参考;;
• InChIKey: BWDBEAQIHAEVLV-UHFFFAOYSA-N
• InChI=1S/C8H18O/c1-8(2)6-4-3-5-7-9/h8-9H,3-7H2,1-2H3…
• 计算化学: 氢键受体数1.0氢键供体数1.0可旋转键数5.0

相似化合物

物理性质

• 熔点-117.1 °C
• 沸点170.96 °C at 760 mmHg
• 闪点71.1 °C
• 密度0.832
• PSA:20.23
• LogP:2.1951
• 折射率1.4046 (估算)
• 蒸汽压0.207 mmHg at 25 °C
• 溶解性Insoluble (NIOSH, 2024) | Soluble in ethanol, ether | In water, 640 mg/L at 25 °C | Insoluble
• 敏感性ISOOCTYL ALCOHOL attacks plastics. REF [Handling Chemicals Safely, 1980. p. 236]. Acetyl bromide reacts violently with alcohols or water, [Merck 11th ed., 1989]. Mixtures of alcohols with concentrated sulfuric acid and strong hydrogen peroxide can cause explosions. Example: An explosion will occur if dimethylbenzylcarbinol is added to 90% hydrogen peroxide then acidified with concentrated sulfuric acid. Mixtures of ethyl alcohol with concentrated hydrogen peroxide form powerful explosives. Mixtures of hydrogen peroxide and 1-phenyl-2-methyl propyl alcohol tend to explode if acidified with 70% sulfuric acid, [Chem. Eng. News 45(43):73(1967); J, Org. Chem. 28:1893(1963)]. Alkyl hypochlorites are violently explosive. They are readily obtained by reacting hypochlorous acid and alcohols either in aqueous solution or mixed aqueous-carbon tetrachloride solutions. Chlorine plus alcohols would similarly yield alkyl hypochlorites. They decompose in the cold and explode on exposure to sunlight or heat. Tertiary hypochlorites are less unstable than secondary or primary hypochlorites, [NFPA 491 M, 1991]. Base-catalysed reactions of isocyanates with alcohols should be carried out in inert solvents. Such reactions in the absence of solvents often occur with explosive violence, [Wischmeyer(1969)].
• 外观形态液体；由结构相近的支链伯醇异构体组成的混合物
• 储存条件Store at room temperature
• 产品应用该化合物用于陶瓷,纸张涂料,纺织品和乳胶橡胶;

MSDS等安全信息

• GHS象形图
• GHS符号GHS07;
  注释: Exclamation mark
• 危险类别急性毒性 类别4(经口)
  皮肤腐蚀/刺激 类别2
  严重眼刺激 类别2
  水生慢性毒性 类别3
  急性毒性 类别3(吸入)
  特定目标器官毒性 - 单次接触 类别3
  严重眼损伤 类别1
• 警示词Warning(警告)
• 危险描述H302 |吞咽有害.
  H315 |造成皮肤刺激.
  H319 |造成严重眼刺激.
  H412 |对水生生物有害并具有长期持续影响.
  H331 |吸入会中毒.
  H335 |可能引起呼吸道刺激.
  H336 |可能引起嗜睡或头晕.
  H318 |造成严重眼损伤.
• 防范说明P210-P261-P264-P271-P273-P280-P362+P364-P370+P378-P405-P501
• 危险等级9
• UN编号3082
• 包装等级III
• 危险类别码This is a mixture of closely related isomeric, primary alcohols with branched chains such as 2-Ethylhexanol. [NIOSH] Isooctyl alcohol causes anesthesia after percutaneous absorption in experimental animals. [ACGIH] A skin, eye, and respiratory tract irritant; Inhalation of high concentrations may cause CNS effects; [ICSC]

欧盟法规

合成工艺路线路线简述

海关参考信息

• 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