1,​3-​Benzodioxole-​5-​acetonitrile 胡椒乙腈

CAS 4439-02-5 MFCD00005835

化学结构图

4439-02-5
SMILES: N#CCc1ccc2c(c1)OCO2

化学属性

Mol. FormulaC9H7NO2
Mol. Weight161.16
Melting Point43-45°C
Flash Point>110°(230°F)
TSCANo
Boiling Point299.7°C at 760 mmHg

别名和识别编码

Chemical Name1,​3-​Benzodioxole-​5-​acetonitrile
CAS Number4439-02-5
Alfabeta NameMETHYLENEDIOXYPHENYLACETONITRILE 34-,
MDL NumberMFCD00005835
Synonym 2-(Benzo[d][1,3]dioxol-5-yl)acetonitrile {LY} 2-(Benzo[d][1,3]dioxol-5-yl)acetonitrile {} {LY} 2-(Benzo[d][1,3]dioxol-5-yl)acetonitrile {} {} {LY} 2-(Benzo[d][1,3]dioxol-5-yl)acetonitrile {} {} {} {LY} 2-(Benzo[d][1,3]dioxol-5-yl)acetonitrile {} {} {} {} {LY} 2-(Benzo[d][1,3]dioxol-5-yl)acetonitrile {} {} {} {} {} {LY} 2-(Benzo[d][1,3]dioxol-5-yl)acetonitrile {} {} {} {} {} {} {LY} 2-(Benzo[d][1,3]dioxol-5-yl)acetonitrile {} {} {} {} {} {} {} {LY} 2-(Benzo[d][1,3]dioxol-5-yl)acetonitrile {} {} {} {} {} {} {} {} {LY} 2-(Benzo[d][1,3]dioxol-5-yl)acetonitrile {} {} {} {} {} {} {} {} {} {LY} 2-(Benzo[d][1,3]dioxol-5-yl)acetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(Benzo[d][1,3]dioxol-5-yl)acetonitrile {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(Benzo[d][1,3]dioxol-5-yl)acetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(Benzo[d][1,3]dioxol-5-yl)acetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(Benzo[d][1,3]dioxol-5-yl)ace
EC Number224-655-9
Beilstein Registry Number7739
PubChem Substance ID78178
Reaxys-RN7739
Chemical Name Translation胡椒乙腈
InChIKeyZQPBOYASBNAXOZ-UHFFFAOYSA-N
LabNetwork Molecule IDLN00158414
InChIInChI=1S/C9H7NO2/c10-4-3-7-1-2-8-9(5-7)12-6-11-8/h1-2,5H,3,6H2
Canonical SMILESN#CCC1=CC=C(OCO2)C2=C1
信息真实价格透明    资金保障    专业采购外包团队在线服务   
信息真实价格透明    资金保障    专业采购外包团队在线服务   
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分类

  • {SNA} Building Blocks, C8 to C9, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds, Organic Building Blocks

安全信息

Warnings IRRITANT
Safety Statements
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
Packing GroupIII
UN Number 3439
Risk Statements
  • R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
WGK Germany3
GHS Symbol
Precautionary statements
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P332+P313
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H332 Harmful if inhaled 吸入有害
  • H302 Harmful if swallowed 吞食有害
  • H312 Harmful in contact with skin 皮肤接触有害
  • H302+H312+H332
Signal word Warning
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes 6.1 Xn
Hazard Class6.1
Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • 1,3-苯并二氧杂环戊烯-5-乙腈价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/04/16 M1923 3,4-亚甲基二氧代苯基乙腈 3,4-Methylenedioxyphenylacetonitrile 5G 538元 2011/04/16 M1923 3,4-亚甲基二氧代苯基乙腈 3,4-Methylenedioxyphenylacetonitrile 25G 1630元 2010/06/21 163350500 1,3-苯并二氧杂环戊烯-5-乙腈 3,4-(Methylenedioxy)phenylacetonitrile 98% 50 GR 3488元
  • TCI Shanghai:1,3-苯并二氧杂环戊烯-5-乙腈, 3,4-Methylenedioxyphenylacetonitrile,>;98.0%(GC)(4439-02-5)
  • 上游原料:二甲基亚砜 --> 氰化钠 --> 邻苯二酚 --> 二氯乙烷 --> 1,2-亚甲二氧基苯 --> 三聚甲醛
  • 下游产品:3,4-亚甲二氧苯乙胺
  • 用途一:用作医药中间体
  • Alfa Aesar:3,4-(亚甲二氧基)苯乙腈,98+% 3,4-(Methylenedioxy)phenylacetonitrile, 98+%(4439-02-5)
  • Sigma Aldrich:4439-02-5(sigmaaldrich)
  • MOL 文件:4439-02-5.mol
  • 方法一:用邻苯二酚在二甲基亚砜中与二氯乙烷、氢氧化钠环合，生成胡椒环，然后以三聚甲醛及浓盐酸氯甲基化，得胡椒氯苄，再以氰化钠氰化制得该品。
  • 用途二:小檗碱盐酸盐（盐酸黄连素）的中间体。
  • Acros Organics:3,4-(亚甲基二氧基)苯基乙腈 3,4-(Methylenedioxy)phenylacetonitrile, 98%(4439-02-5)
  • 1,3-苯并二氧杂环戊烯-5-乙腈价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 M1923 3,4-亚甲基二氧代苯基乙腈 3,4-Methylenedioxyphenylacetonitrile 5G 487元 2014/06/02 M1923 3,4-亚甲基二氧代苯基乙腈 3,4-Methylenedioxyphenylacetonitrile 25G 1500元 2010/06/21 163350500 1,3-苯并二氧杂环戊烯-5-乙腈 3,4-(Methylenedioxy)phenylacetonitrile 98% 50 GR 3488元
  • MSDS 信息:1,3-Benzodioxole-5-acetonitrile(4439-02-5).msds
  • 图谱信息:1,3-苯并二氧杂环戊烯-5-乙腈(4439-02-5)红外图谱(IR2) 1,3-苯并二氧杂环戊烯-5-乙腈(4439-02-5)核磁图( 13 CNMR) 1,3-苯并二氧杂环戊烯-5-乙腈(4439-02-5)核磁图( 1 HNMR) 1,3-苯并二氧杂环戊烯-5-乙腈(4439-02-5)质谱(MS) 1,3-苯并二氧杂环戊烯-5-乙腈(4439-02-5)红外图谱(IR1)

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Cyanides/Nitriles - Nitrogen Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Cyanides/Nitriles - Nitrogen Compounds
  6. C8 to C9 - Cyanides/Nitriles
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Cyanides/Nitriles - Nitrogen Compounds
  6. C8 to C9 - Cyanides/Nitriles
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Cyanides/Nitriles
  6. C6 to C7

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