4-Bromophenylacetonitrile 对溴苯乙腈

CAS 16532-79-9 MFCD00001916

化学结构图

16532-79-9
SMILES: N#CCc1ccc(Br)cc1

化学属性

Mol. FormulaC8H6BrN
Mol. Weight196.04
Density1.487
Flash Point113°C
TSCAYes
Melting Point47-49°C
Boiling Point116-118 °C at 3 mmHg
Solubility略溶于水

别名和识别编码

Chemical Name4-Bromophenylacetonitrile
CAS Number16532-79-9
Synonym 4-Bromophenylacetonitrile {LY} 4-Bromophenylacetonitrile {} {LY} 4-Bromophenylacetonitrile {} {} {LY} 4-Bromophenylacetonitrile {} {} {} {LY} 4-Bromophenylacetonitrile {} {} {} {} {LY} 4-Bromophenylacetonitrile {} {} {} {} {} {LY} 4-Bromophenylacetonitrile {} {} {} {} {} {} {LY} 4-Bromophenylacetonitrile {} {} {} {} {} {} {} {LY} 4-Bromophenylacetonitrile {} {} {} {} {} {} {} {} {LY} 4-Bromophenylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromophenylacetonitrile {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromophenylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromophenylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromophenylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromophenylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromophenylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromophenylacetonitrile {} {} {} {} {} {} {} {} {} {}
MDL NumberMFCD00001916
EC Number240-602-2
Beilstein Registry Number1861069
PubChem Substance ID125308620
Alfabeta NameBROMOPHENYLACETONITRILE 4()-
Chemical Name Translation对溴苯乙腈
Reaxys-RN1861069
Wiswesser Line NotationNC1R DE
InChIKeyMFHFWRBXPQDZSA-UHFFFAOYSA-N
LabNetwork Molecule IDLN00008244
Canonical SMILESN#CCC1=CC=C(Br)C=C1
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分类

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

产品应用

  • A chemical model used for the study and analysis of human buccal absorption of pharmaceuticals.

相关文献及参考

  • Beilstein:9,451
  • Vora, K., et al.: J. Pharm. Sci., 61, 1785 (1972),

安全信息

RTECSAL8090000
Safety Statements
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后,立即用大量水冲洗并征求医生意见;
  • S26/36/37/39
  • 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;
  • S38 In case of insufficient ventilation wear suitable respiratory equipment 通风不良时,佩带适当的呼吸器;
Packing GroupIII
UN Number 1694 3276 3335 UN3449
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
  • R20/21/22/36/37/39
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
WGK Germany3
GHS Symbol
Precautionary statements
  • 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。
  • 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。
  • P284 Wear respiratory protection.? 佩戴呼吸保护装置。
  • P301+P310
  • P302+P350
  • P304+P340+P310
  • P305+P351+P338
  • P332+P313
  • P337+P313
  • P403+P233
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
Hazard statements
  • H332 Harmful if inhaled 吸入有害
  • H315 Causes skin irritation 会刺激皮肤
  • H301 Toxic if swallowed 吞食有毒
  • H312 Harmful in contact with skin 皮肤接触有害
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H300+H310+H330
  • H312+H332
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Hazard Codes 9
Warnings IRRITANT
Hazard Class6.1
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 56 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#03252

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

  • 可燃性危险特性:热分解排出有毒氮氧化物, 溴化物和氰化物烟雾
  • 类别:有毒物质
  • 毒性分级:高毒
  • Sigma Aldrich:16532-79-9(sigmaaldrich)
  • MSDS 信息:4-Bromobenzyl cyanide(16532-79-9).msds
  • 储运特性:库房通风低温干燥; 与食品原料类分开存放
  • Hazard Note:Irritant
  • Acros Organics:对溴苯乙腈 4-Bromophenylacetonitrile, 99%(16532-79-9)
  • 对溴苯乙腈价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 xw010165 4-溴氰苄 25g 200元 2011/04/16 B1134 4-溴苯乙腈 4-Bromobenzyl Cyanide 250G 1650元 2011/04/16 B1134 4-溴苯乙腈 4-Bromobenzyl Cyanide 25G 240元
  • Alfa Aesar:4-溴苯基乙腈,97% 4-Bromophenylacetonitrile, 97%(16532-79-9)
  • 灭火剂:水,干粉、干砂、二氧化碳、泡沫、1211灭火剂
  • MOL 文件:16532-79-9.mol
  • 图谱信息:对溴苯乙腈(16532-79-9)质谱(MS) 对溴苯乙腈(16532-79-9)红外图谱(IR1) 对溴苯乙腈(16532-79-9)红外图谱(IR2)
  • 下游产品:7-溴-1,2,3,4-四氢异喹啉
  • 急性毒性:静脉-小鼠 LD50: 56 毫克/公斤
  • 微溶于水。

系列性分类


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