CAS: 94088-46-7; 2-Fluoro-6-Methoxybenzonitrile

• 英文名称2-Fluoro-6-Methoxybenzonitrile
• 中文名称2-氟-6-甲氧基苯甲腈
• IUPAC名称2-fluoro-6-methoxybenzonitrile
• 其它别名2-Fluoro-6-methoxybenzonitrile; 2-Methoxy-6-fluorobenzonitrile; 6-Methoxy-2-fluorobenzonitrile
• CAS编号94088-46-7
• MFCD编号:MFCD00042291
• EINECS号:302-047-5
• 分子式:C8H6FNO
• 分子量:151.14
• 产品CID: 1986976
• 产品分类有机原料→分子砌块→芳环类化合物→苯类化合物

• 相似结构搜索
• 产品信息参考;;
• InChIKey: YPMSIWYNTPSPMV-UHFFFAOYSA-N
• InChI=1S/C8H6FNO/c1-11-8-4-2-3-7(9)6(8)5-10/h2-4H,1H3…
• 计算化学: 氢键受体数2.0氢键供体数0.0可旋转键数1.0

物理性质

• 熔点103-105°C
• 沸点232.1±20.0 °C at 760 mmHg
• 闪点94.1±21.8 °C
• 密度1.2±0.1 g/cm3
• PSA:33.02
• LogP:1.70598
• 折射率1.505
• 蒸汽压0.1±0.5 mmHg at 25°C
• 溶解性Soluble In Methanol
• 敏感性常温常压下稳定，避免与强氧化剂接触。
• 外观形态白色至几乎白色粉末至晶体
• 储存条件密封, 常温干燥保存

MSDS等安全信息

• GHS象形图
• GHS符号GHS07;
  注释: Exclamation mark
• 危险类别特定目标器官毒性 - 单次接触 类别3
  皮肤腐蚀/刺激 类别2
  严重眼刺激 类别2
  急性毒性 类别3(吸入)
  急性毒性 类别3(经皮)
  急性毒性 类别3(经口)
  急性毒性 类别4(吸入)
  急性毒性 类别4(经皮)
  急性毒性 类别4(经口)
  严重眼刺激 类别2A
• 警示词Warning(警告)
• 危险描述H335 |可能引起呼吸道刺激.
  H315 |造成皮肤刺激.
  H319 |造成严重眼刺激.
  H331 |吸入会中毒.
  H311 |皮肤接触会中毒.
  H301 |吞咽会中毒.
  H332 |吸入有害.
  H312 |皮肤接触有害.
  H302 |吞咽有害.
• 防范说明P261-P264-P271-P280-P302+P352-P304+P340-P362-P405-P501
• 危险等级6.1
• UN编号3276
• 危险品标志Xi,T,Xn
• 风险等级Toxic
• 包装等级III
• 安全声明26-36
• 危险类别码36/37/38-20/21/22
• WGK Germany3

欧盟法规

上下游产品

合成工艺路线路线简述

• 1897-52-5 = 94088-46-7
  反应条件:1.1 Solvents: Methanol; Rt; Overnight,Rt
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  参考文献:World Intellectual Property Organization]
  
  146137-74-8 = 94088-46-7
  反应条件:1.1 Reagents: Sodium Acetate,Hydroxyamine Hydrochloride Solvents: Formic Acid,Water; 80 °C
  标题:Synthesis Of Aryl Dihydrothiazol Acyl Shikonin Ester Derivatives As Anticancer Agents Through Microtubule Stabilization
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  参考文献:Biochemical Pharmacology (Amsterdam 日期:2015 卷标:96(2) 页码:93-106]
  
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  参考文献:United States]
  
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  参考文献:Journal Of Heterocyclic Chemistry 日期:1997 卷标:34(4) 页码:1163-1172]
  
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  标题:Preparation Of Pyrimidine-Fused Tricyclic Compounds Capable Of Inhibiting Tyrosine Kinases Of The Epidermal Growth Factor Receptor Family
  参考文献:World Intellectual Property Organization]
  
  1897-52-5 = 94088-46-7
  反应条件:1.1 Solvents: Methanol; Rt -> 5 °C1.2 0 - 5 °C; Overnight,Rt
  标题:Preparation Of 2-Cyano-3-(Halo)Alkoxybenzenesulfonamides As Pesticides.
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  1897-52-5 = 94088-46-7
  反应条件:1.1 Solvents: Methanol
  标题:Direct Synthesis Of 2,4-Diaminoquinazolines From 2-Fluorobenzonitriles
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  参考文献:Journal Of Heterocyclic Chemistry 日期:1988 卷标:25(4) 页码:1173-7]
  
  1897-52-5 = 94088-46-7
  反应条件:1.1 Solvents: Methanol,Acetonitrile; 20 °C1.2 Reagents: Water
  标题:Synthesis Of 2-Fluoro-6-Methoxybenzoic Acid
  作者:Tian,Zhaojun; Jiang,Yunxia; Yang,Chunhe
  参考文献:Huagong Shengchan Yu Jishu 日期:2011 卷标:18(6) 页码:4-5]
  
  146137-74-8 = 94088-46-7
  反应条件:1.1 Reagents: Sodium Acetate,Hydroxyamine Hydrochloride Solvents: Formic Acid,Water; 12 H,80 °C
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  参考文献:Rsc Advances 日期:2021 卷标:11(39) 页码:24232-24237]
  
  1897-52-5 = 94088-46-7
  反应条件:1.1 Solvents: Methanol; Rt; Overnight,Rt
  标题:Preparation Of Triazolopyridine Compounds Useful In The Treatment Of Diseases Or Disorders Mediated By Eed And/or Prc2
  参考文献:World Intellectual Property Organization]
  
  1897-52-5 = 94088-46-7
  反应条件:1.1 Solvents: Methanol; Rt -> 5 °C; 5 °C; Overnight,Rt
  标题:Preparation Of Aminothiocarbonyl-Substituted Benzenesulfonamides And Pyridinesulfonamides As Pesticides For The Protection Of Plants Against Animal Pests And Insects And Particularly Against Aphids And Thrips
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海关参考信息

• 2902300000-甲苯
  2905110000-甲醇
  2907121100-间甲酚
  2908199090-其他酚的卤化衍生物
• 💡 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。
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