m-Tolunitrile 间甲基苯腈

CAS 620-22-4 MFCD00001808

化学结构图

620-22-4
SMILES: Cc1cccc(C#N)c1

化学属性

Mol. FormulaC8H7N
Mol. Weight117.15
Refractive index1.5240 to 1.5270
Density0.976 g/mL at 25 °C(lit.)
Boiling Point210°C(lit.)
Melting Point-23 °C(lit.)
Flash Point86°C(lit.)
TSCAYes
Solubility<0.1 G/100 ML AT 25 ºC
Appearance 无色透明液体或结晶体。

别名和识别编码

Chemical Namem-Tolunitrile
Synonym 3-甲基苯甲腈 m-Toluenenitrile m-Methylbenzonitrile 3-Methylbenzenecarbonitrile; m-Cyanotoluene; 3-Methylbenzonitrile; m-Toluonitrile; CNT; MTN m-Tolylnitrile 3-CYANOTOLUENE m-Tolunitril 间对甲苯基氰 m-Cyanotoluene CNT MTN 3-Toluenkarbonitril m-Toluenenitrile 间氰基甲苯 3-Cyantoluol 3-TOLUNITRILE 3-METHYLBENZENECARBONITRILE m-Methylbenzonitrile 间甲苯腈 3-甲基苯腈 m-Toluonitrile μ-Tolunitrile 3-Methylbenzonitrile M-toluonitrile Nitril kyseliny m-toluylove 3-Cyanotoluene 3-methyl-benzonitril 3-methyl-benzonitrile 3-Tolylsäurenitril M-TOLUONITRILE 间甲基苯甲腈 间甲基苯腈 3-Tolunitrile m-Tolynitrile MCT 3-甲基苯甲腈,间甲苯腈 m-Tolylnitrile 间甲苯基氰 Benzonitrile, 3-methyl- m-toluonitrile 3-tolyl cyanide 间对甲苯基氰, 98+% 3-Methylbenzenecarbonitrile M-CYANO TOLUENE M-TOLUNITRILE 1-Methyl-3-cyanobenzene 3-Tolyl cyanide 3-METHYLBENZONITRILE meta-Tolunitrile m-Cyanotoluene m-Tolunitrile 间甲苯甲腈
MDL NumberMFCD00001808
CAS Number620-22-4
EC Number210-631-5
Beilstein Registry Number9,477
PubChem Substance ID12104
Reaxys-RN507391
Chemical Name Translation间甲基苯腈
Wiswesser Line NotationNCR C1
InChIKeyBOHCMQZJWOGWTA-UHFFFAOYSA-N
LabNetwork Molecule IDLN00225516
InChIInChI=1S/C8H7N/c1-7-3-2-4-8(5-7)6-9/h2-5H,1H3
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; 1fragment
  • {SNA} Building Blocks, C8 to C9, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds, Organic Building Blocks

产品应用

  • 医药、农药、染料中间体。

相关文献及参考

  • Short: III/20a
  • Beilstein:9,477
  • Short: II/2
  • Short: III/35D2

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • 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
  • H227 Combustible liquid 可燃液体
Personal Protective Equipment Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSXV0525000
Precautionary statements
  • 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。
  • 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
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • 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。
  • 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。
  • P332+P313
  • P370+P378
  • P305+P351
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P305+P351+P338+P337+P313
  • P302+P350
Signal word Warning
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
  • R36/38 Irritating to eyes and skin 对眼睛和皮肤有刺激性
  • 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
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;
  • S37 Wear suitable gloves 戴适当手套;
  • 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);
Hazard Codes Xn,Xi Xi
UN Number 3276
Warnings 危化品目录(2015) 危险化学品
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >300 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 21,906,1978

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia,
   Italy)  V.8-43 1953-88 For publisher information, see FRMCE8
   Volume(issue)/page/year: 41,41,1986

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 3 gm/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

其他信息

  • 图谱信息:间甲基苯腈(620-22-4)Raman光谱 间甲基苯腈(620-22-4)红外图谱(IR1) 间甲基苯腈(620-22-4)核磁图( 13 CNMR) 间甲基苯腈(620-22-4)核磁图( 1 HNMR) 间甲基苯腈(620-22-4)质谱(MS)
  • TCI Shanghai:间甲基苯腈 m-Tolunitrile,>;98.0%(GC)(620-22-4)
  • 灭火剂:雾状水、泡沫、干粉、二氧化碳、砂土
  • 毒性分级:中毒
  • 类别:有毒物品
  • 刺激数据:皮肤-兔子 500 毫克/24小时 轻度
  • 用途二:医药、农药、染料中间体。
  • MSDS 信息:m-Cyanotoluene(620-22-4).msds
  • Hazard Note:Irritant
  • Sigma Aldrich:620-22-4(sigmaaldrich)
  • Acros Organics:3-甲基苯甲腈 m-Tolunitrile, 99%(620-22-4)
  • 急性毒性:口服-大鼠 LD50: 3000 毫克/ 公斤; 口服-小鼠 LD50: 300 毫克/ 公斤
  • 储运特性:库房通风低温干燥; 与食品、氧化剂、酸类分开储运
  • 可燃性危险特性:明火可燃; 受热放出剧毒含腈气体
  • Alfa Aesar:间对甲苯基氰,98+% m-Tolunitrile, 98+%(620-22-4)
  • 间甲基苯腈价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 80131980 间甲苯甲腈 25ml 850元 2011/04/16 T0305 间甲基苯腈 m-Tolunitrile 25ML 251元 2011/04/16 T0305 间甲基苯腈 m-Tolunitrile 500ML 1600元
  • 用途一:是有机合成中间体,主要用于合成间甲基苯甲酸
  • MOL 文件:620-22-4.mol
  • 下游产品:3-氰基苯甲酰氯 --> 3-甲基苄胺 --> 3-氰基苯甲酸

系列性分类


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