2-Benzylidenemalononitrile 2-苄亚基丙二腈

CAS 2700-22-3 MFCD00001855

化学结构图

2700-22-3
SMILES: N#CC(C#N)=Cc1ccccc1

化学属性

Mol. FormulaC10H6N2
Mol. Weight154.17
Melting Point83-85 °C
TSCANo
Boiling Point120-125 °C at 0.6 mmHg
Flash Point120-125°C/0.6mm

别名和识别编码

Chemical Name2-Benzylidenemalononitrile
MDL NumberMFCD00001855
PubChem Substance ID17608
CAS Number2700-22-3
EC Number220-283-6
Beilstein Registry Number9,895
Reaxys-RN1907519
Synonym 2-Benzylidenemalononitrile {LY} 2-Benzylidenemalononitrile {} {LY} 2-Benzylidenemalononitrile {} {} {LY} 2-Benzylidenemalononitrile {} {} {} {LY} 2-Benzylidenemalononitrile {} {} {} {} {LY} 2-Benzylidenemalononitrile {} {} {} {} {} {LY} 2-Benzylidenemalononitrile {} {} {} {} {} {} {LY} 2-Benzylidenemalononitrile {} {} {} {} {} {} {} {LY} 2-Benzylidenemalononitrile {} {} {} {} {} {} {} {} {LY} 2-Benzylidenemalononitrile {} {} {} {} {} {} {} {} {} {LY} 2-Benzylidenemalononitrile {} {} {} {} {} {} {} {} {} {} {LY} 2-Benzylidenemalononitrile {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Benzylidenemalononitrile {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Benzylidenemalononitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Benzylidenemalononitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Benzylidenemalononitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Benzylidenemalononitrile {} {} {} {} {} {} {} {} {} {} {} {} {
Chemical Name Translation2-苄亚基丙二腈
Wiswesser Line NotationNCYCN&1R
InChIKeyWAVNYPVYNSIHNC-UHFFFAOYSA-N
LabNetwork Molecule IDLN01066051
InChIInChI=1S/C10H6N2/c11-7-10(8-12)6-9-4-2-1-3-5-9/h1-6H
Canonical SMILESC1=CC=C(C=C1)C=C(C#N)C#N
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分类

  • Building Blocks, C10 to C27, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds, Organic Building Blocks
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; 1fragment
  • {SNA} Building Blocks, C10 to C27, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds, Organic Building Blocks

相关文献及参考

  • For details of a cycloaddition reaction with an acetal of cyclopropenone, which behaves as a 1,3-dipole, see: Org. Synth. Coll., 8, 173 (1993):
  • Short: EINECS
  • For a review of the chemistry of arylidenemalononitriles, see: Chem. Rev., 80, 329 (1980).
  • Short: III/10a
  • A Pd(0)-catalyzed cycloaddition reaction with vinyloxiranes has been reported, leading to tetrahydrofuran derivatives: J. Org. Chem., 63, 3067 (1998).

安全信息

WGK Germany3
GHS Symbol
Precautionary statements
  • 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+P310+P330
  • P301+P312
  • P302+P350
  • P302+P352
  • P304+P312
  • P304+P340
  • P305+P351+P338
  • 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)。
  • P322 Specific measures (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
  • P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H301 Toxic if swallowed 吞食有毒
  • H302 Harmful if swallowed 吞食有害
  • H302+H312+H332
  • H312 Harmful in contact with skin 皮肤接触有害
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H332 Harmful if inhaled 吸入有害
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Hazard Codes Xn
RTECSOO3500000
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Signal word Warning {} {} {} {} {} {TCI}
UN Number 3439 3276 UN3439
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;
  • 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;
  • 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
  • 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
Packing GroupIII
Hazard Class6.1
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 40 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   BCPCA6 Biochemical Pharmacology.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.1-    1958-  Volume(issue)/page/year:
   14,1325,1965

TYPE OF TEST            : LC - Lethal concentration
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >1450 mg/m3/10M
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NDRC** National Defense Research Committee, Office of Scientific Research
   and Development, Progress Report.  Volume(issue)/page/year:
   NDCrc-132,Dec,1942

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 30 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NATUAS Nature.  (Nature Subscription Dept., POB 1018, Manasguan, NJ 08736)
   V.1-    1869-  Volume(issue)/page/year: 228,1315,1970

Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • 苄烯丙二腈价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 B0947 苯亚甲基丙二腈 Benzalmalononitrile 10G 247元 2014/06/02 B0947 苯亚甲基丙二腈 Benzalmalononitrile 25G 506元 2010/06/21 164291000 苄烯丙二腈 Benzylidenemalononitrile 98% 100 GR 1570元
  • TCI Shanghai:苯亚甲基丙二腈 Benzalmalononitrile,>;98.0%(GC)(2700-22-3)
  • MOL 文件:2700-22-3.mol
  • Sigma Aldrich:2700-22-3(sigmaaldrich)
  • Acros Organics:苄亚基丙二腈 Benzylidenemalononitrile, 98%(2700-22-3)
  • 图谱信息:苄烯丙二腈(2700-22-3)核磁图( 1 HNMR) 苄烯丙二腈(2700-22-3)核磁图( 13 CNMR) 苄烯丙二腈(2700-22-3)红外图谱(IR2) 苄烯丙二腈(2700-22-3)红外图谱(IR1) 苄烯丙二腈(2700-22-3)质谱(MS)
  • Alfa Aesar:苯亚甲基丙二腈,98+% Benzylidenemalononitrile, 98+%(2700-22-3)

系列性分类


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