Hexanenitrile 己腈

CAS 628-73-9 MFCD00001979

化学结构图

628-73-9
SMILES: CCCCCC#N

化学属性

Mol. FormulaC6H11N
Mol. Weight97.16
Refractive index1.4050 to 1.4090
Boiling Point160°C
Density0.809 g/mL at 25 °C(lit.)
Melting Point-80 °C(lit.)
Flash Point43°C(lit.)
Solubility不溶于水,可混溶于乙醇、乙醚。

别名和识别编码

Chemical NameHexanenitrile
Synonym Hexansäurenitril n-Caproic nitrile Capronitril CAPROIC NITRILE 正己腈 Tricapronile 氰化正戊烷 N-HEXANOIC ACID NITRILE n-Capronitrile Amyl cyanide N-PENTYL CYANIDE PENTYLCYANIDE 戊基氰 Capronitrile Hexanonitrile n-hexanenitrile 己腈 HEXANENITRILE N-AMYL CYANIDE HEXANONITRILE n-Amyl cyanide n-Pentyl cyanide HEXANOIC ACID NITRILE 1-pentanecarbonitrile 已腈 正戊基腈 1-Cyanopentane CAPRONITRILE N-HEXANENITRILE 1-CYANOPENTANE N-CAPRONITRILE 氰戊烷 正戊基氰
MDL NumberMFCD00001979
CAS Number628-73-9
PubChem Substance ID12352
EC Number211-052-0
Reaxys-RN1633601
Beilstein Registry Number2,324
Chemical Name Translation己腈
InChIKeyAILKHAQXUAOOFU-UHFFFAOYSA-N
Wiswesser Line NotationNC5
LabNetwork Molecule IDLN01742486
InChIInChI=1S/C6H11N/c1-2-3-4-5-6-7/h2-5H2,1H3
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   
品牌质保精细包装    现货库存    一流品牌服务   

分类

  • {uni_hamburg} no charge; 1fragment
  • {SNA} Building Blocks, C6 to C7, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds, Organic Building Blocks

相关文献及参考

  • Short: III/20a Title: Nuclear Quadrupole Resonance Spectroscopy Data: Nuclei D ... Cl Author: Chihara, H.; Nakamura, N. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: III/20a Year: 1988 Keyword: NQR ISBN: 3-540-18161-X ISBN: 978-3-540-18161-3 Internet Resource: DOI:10.1007/b31153 RefComment: IX,677 pages. Hardcover Abstract: Nuclear Quadrupole Resonance Spectroscopy has become a standard method for structural research in molecular and solid state physics as well as for different branches of chemistry. The volumes cover data for more than 8,000 substances in the solid state. Data for free molecules have been published in volumes II/14 and II/15 of the New Series. The tables are arranged according to the atomic number of the elements.
  • Short: III/35C1 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Hydrogen-1, Part 1: Aliphatic and Aromatic Hydrocarbons, Steroids, Carbohydrates Author: Gupta, R.R.; Jain, M. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35C1 Year: 2000 ISBN: 3-540-66780-6 ISBN: 978-3-540-66780-3 Internet Resource: DOI:10.1007/b60149 RefComment: VII, 310 pages. With CD-ROM. Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), and carbon-13 (subvol. D) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
  • Short: III/38B Title: Refractive Indices of Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnst

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H226 Flammable liquid and vapour 易燃液体和蒸气
  • H302 Harmful if swallowed 吞食有害
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSMO3900000
Precautionary statements
  • P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
  • P233 Keep container tightly closed. ?保持容器密闭。
  • P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
  • P241 Use explosion-proof electrical/ventilating/lighting/…/equipment. 使用防爆电气/通风/照明/ .../设备。
  • P241+P242+P243
  • P242 Use only non-sparking tools. 只能使用无火花工具。
  • P243 Take precautionary measures against static discharge. 采取预防措施,防止静电放电。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • 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。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • 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。
  • P301+P312
  • P301+P312+P330
  • P302+P352
  • P302+P352+P332+P313+P362+P364
  • P303+P361+P353
  • P304+P340
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适,呼叫解毒中心或医生/医师。
  • P321 Specific treatment (see … on this label). 具体治疗(见本标签上的)。
  • P330 Rinse mouth. 漱口
  • P332+P313
  • P337+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
  • P370+P378
  • P403+P233
  • P403+P235
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Warning
Hazard Codes Xn
Safety Statements
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套;
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R22 Harmful if swallowed 吞咽有害
  • R10 Flammable 易燃
UN Number 1993 UN 1993 3/PG 3
Packing GroupIII
Hazard Class3
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 - guinea pig
DOSE/DURATION           : 310 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   COREAF Comptes Rendus Hebdomadaires des Seances, Academie des Sciences.
   (Paris, France)  V.1-261, 1835-1965.  For publisher information, see CRASEV.
    Volume(issue)/page/year: 153,895,1911

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 463 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NEZAAQ Nippon Eiseigaku Zasshi.  Japanese Journal of Hygiene.  (Nippon Eisei
   Gakkai, c/o Kyoto Daigaku Igakubu, Konoe-cho, Yoshida, Sakyo-ku, Kyoto 606,
   Japan)  V.1-    1946-  Volume(issue)/page/year: 39,423,1984

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 42 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   COREAF Comptes Rendus Hebdomadaires des Seances, Academie des Sciences.
   (Paris, France)  V.1-261, 1835-1965.  For publisher information, see CRASEV.
    Volume(issue)/page/year: 153,895,1911

其他信息

  • MSDS 信息:己腈(628-73-9).msds
  • 下游产品:己酸 --> 2-正丁基-2-苯基-3-(1H-咪唑-1-基)丙腈
  • 用途一:用于有机合成。
  • 灭火剂:干粉、泡沫、二氧化碳、砂土。
  • 上游原料:乙醚 --> 乙酰胺
  • Sigma Aldrich:628-73-9(sigmaaldrich)
  • MOL 文件:628-73-9.mol
  • 毒性分级:高毒
  • 急性毒性:口服-小鼠 LD50:463 毫克/公斤
  • 可燃性危险特性:明火可燃; 燃烧释放有毒氮氧化物和氰化物烟雾
  • TCI Shanghai:己腈 Hexanenitrile,>;96.0%(GC)(628-73-9)
  • 外观性质:无色液体。
  • 已腈价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 H0102 己腈 Hexanenitrile 25ML 955元
  • 图谱信息:已腈(628-73-9)红外图谱(IR2) 已腈(628-73-9)核磁图( 13 CNMR) 已腈(628-73-9)核磁图( 1 HNMR) 已腈(628-73-9)质谱(MS) 已腈(628-73-9)红外图谱(IR1) 已腈(628-73-9)Raman光谱
  • 储运特性:库房通风低温干燥; 与酸类、氧化剂、食品添加剂分开存放
  • 方法一:由正已酰胺与氯化亚砜反应而得。将正乙酰胺与新蒸过的氯化亚砜回流反应1h,待氯化氢不再急剧逸出时,将反应液常压蒸除过量的氯化亚砜,放冷后,加无水乙醚萃取。取乙醚萃取液蒸除乙醚,所得产物进行蒸馏,收集161-163℃馏分,得己腈,收率86%。
  • 类别:有毒物品

系列性分类


相关产品推荐