Glycolonitrile (剧毒品，不能销售)羟基乙腈

CAS 107-16-4 MFCD00042731

化学结构图

107-16-4
SMILES: N#CCO

化学属性

Mol. FormulaHOCH2CN
Mol. Weight57.05
Density1.045 g/mL at 25 °C
Refractive indexn20/D 1.375
Flash Point133 ºF
Melting Point-72 ºC
Boiling Point183 ºC
Solubility>=10 G/100 ML AT 20 ºC
Appearance 无色油状液体。熔点-67℃，沸点183℃，119℃（3.2kPa），98℃（1.33kPa），相对密度1.100，折射率1.4117。可溶于乙醇和乙醚。易聚合。

别名和识别编码

Chemical NameGlycolonitrile
Synonym 2-Hydroxyethannitril 甲醛氰醇 Hydroxymethylnitrile 乙醇腈 Glykolsäurenitril Acetonitrile, hydroxy- Hydroxyactonitrile Hydroxymethyl cyanide 乙醇腈 溶液 氰基甲醇 甲醛氰醇 GLYCOLONITRILE GLYCOLIC ACID NITRILE glycolic acid nitrile alpha-hydroxymethylcyanide Cyanomethanol,glycolonitrile glycollonitrile glycolicnitrile Usaf a-8565 Glycolic nitrile 2-Hydroxyethanenitrile Cyanomethanol 2-Hydroxymethylnitrile 乙醇腈 溶液 羟基乙醇 Formaldehyde cyanohydrin FORMALDEHYDE CYANHYDRIN alpha-hydroxyacetonitrile 氰基甲醇 Cyanomethyl alcohol hydroxy-acetonitril 羥乙腈 乙醇氰 cyanomethanol hydroxyacetonitrile HYDROXYACETONITRILE 2-Hydroxyacetonitrile Glykolonitril 羟乙腈 hydroxy-acetonitrile Hydroxymethylkyanid Formaldehyde, cyanohydrin 羟基乙腈 Glycolonitrile Formaldehyde cyanohydrin; 2-Hydroxymethylnitrile; Cyanomethanol Hydroxyacetonitrile USAF A-8565 Hydroxyazetonitril glycolicacidnitrilesolution FORMALDEHYDE CYANOHYDRIN 2-HYDROXYACETONITRILE Glyconitrile HOCH2CN
MDL NumberMFCD00042731
PubChem Substance ID7857
Beilstein Registry Number605328
EC Number203-469-1
CAS Number107-16-4
Chemical Name Translation(剧毒品，不能销售)羟基乙腈
Wiswesser Line NotationQ1CN
InChIInChI=1S/C2H3NO/c3-1-2-4/h4H,2H2
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分类

  • {SNA} Building Blocks, C1 to C5, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks
  • {uni_hamburg} no charge; alcohol; 1fragment
  • {SA} Building Blocks, C1 to C5, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds, Organic Building Blocks

相关文献及参考

  • Short: II/14a Title: Molecular Constants: Diamagnetic Molecules Author: Demaison, J.; Dubrulle, A.; Hüttner, W.; Tiemann, E. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: II/14a Page: 1-788 Year: 1982 Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy ISBN: 3-540-11365-7 ISBN: 978-3-540-11365-2 Internet Resource: DOI:10.1007/b19966 RefComment: 196 figs., XI
  • Short: II/6 Title: Molecular Constants from Microwave, Molecular Beam, and Electron Spin Resonance Spectroscopy Author: Demaison, J.; Hüttner, W.; Starck, B.; Buck, I.; Tischer, R.; Winnewisser, M. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: II/6 Year: 1974 Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy ISBN: 3-540-05977-6 ISBN: 978-3-540-05977-6 Internet Resource: DOI:10.1007/b19951 RefComment: 153 figs., XIII, 688 pages
  • Short: III/38B Title: Refractive Indices of Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/38B Year: 1996 Keyword: organic compounds; refractive index; liquids ISBN: 3-540-60596-7 ISBN: 978-3-540-60596-6 Internet Resource: DOI:10.1007/b85533 RefComment: VII, 4210 pages, Hardcover Abstract: Volume III/38 Optical Constants provides critically evaluated data on refractive indices of inorganic and organic liquids and their wavelength dependence (dispension). Part A contains the inorganic, organometallic, and organononmetallic liquids, and the binary liquid mixtures (about 900 pure substances and their mixtures). Part B contains data of more than 7600 organic liquids.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/i

安全信息

WGK Germany3
Precautionary statements
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P301+P310
  • P284 Wear respiratory protection.? 佩戴呼吸保护装置。
  • P302+P350
  • 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。
Hazard statements
  • H330 Fatal if inhaled 吸入致命
  • H310 Fatal in contact with skin 皮肤接触致命
  • H300 Fatal if swallowed 吞食致命
GHS Symbol
Signal word Danger
Hazard Codes T+
Safety Statements
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
  • S28 After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) 皮肤接触后，立即用大量…（由生产厂家指定）冲洗；
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
Risk Statements
  • R26/27/28 Very toxic by inhalation, in contact with skin and if swallowed 吸入，皮肤接触及吞食都有剧毒
UN Number UN 3276 6.1/PG 1 3276
Packing GroupI
Hazard Class6.1(a)
RTECSAM0350000
Restrict 剧毒 {} 剧毒化学品
Warnings 危化品目录(2015) 危险化学品 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 15 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans
   Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium)  V.4-   
   1898-  Volume(issue)/page/year: 12,447,1904

TYPE OF TEST            : LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 27 ppm/8H
TOXIC EFFECTS :
   Sense Organs and Special Senses (Eye) - lacrimation
   Behavioral - somnolence (general depressed activity)
REFERENCE :
   34ZIAG "Toxicology of Drugs and Chemicals," Deichmann, W.B., New York,
   Academic Press, Inc., 1969  Volume(issue)/page/year: -,290,1969

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 3 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ZAARAM Zentralblatt fuer Arbeitsmedizin und Arbeitsschutz.  (Darmstadt, Fed.
   Rep. Ger.)  V.1-25, 1951-75.  Volume(issue)/page/year: 19,225,1969

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 8 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ZAARAM Zentralblatt fuer Arbeitsmedizin und Arbeitsschutz.  (Darmstadt, Fed.
   Rep. Ger.)  V.1-25, 1951-75.  Volume(issue)/page/ye

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent

其他信息

  • 下游产品:丙烯酸正丁酯 --> 亚氨基二乙酸 --> 氯吡氰菊酯 --> DL-扁桃酸 --> 肌氨酸钠 --> 甲氧基乙腈
  • 上游原料:氰化钾 --> 稀硫酸 --> 氢氧化钾溶液 --> 甲醛水溶液 --> 氢氰酸
  • 方法一:1.由甲醛与氰化钾反应而得。将37%甲醛水溶液慢慢滴加至氰化钾水溶液中，控制温度不超过10℃。放置10min后，仍在10℃以下搅拌，加入稀硫酸至pH为1.9。然后滴加5%氢氧化钾溶液至pH约为3.0，再加入乙醚，过滤出生成的硫酸钾。滤液用乙醚提取。经干燥后，蒸去乙醚，剩余物进行减压蒸馏，收集100℃（1.33kPa）左右馏分即得成品。2.由甲醛与氢氰酸在催化剂存在下进行反应制得。此外，羟乙腈还可由乙醇与氨经气相催化制得。
  • 用途一:可作为生产甘氨酸、丙二腈、靛蓝染料的中间体
  • MOL 文件:107-16-4.mol
  • Sigma Aldrich:107-16-4(sigmaaldrich)
  • 图谱信息:羟基乙腈(107-16-4)质谱(MS) 羟基乙腈(107-16-4)红外图谱(IR1)
  • MSDS 信息:2-Hydroxymethylnitrile(107-16-4).msds
  • 用途二:有机合成原料。

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. Carbonyl Compounds 羰基化合物
  5. Carboxylic Acids - Carbonyl Compounds
  6. C1 to C5 - Carboxylic Acids

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