Cyclohex-3-Enecarbonitrile 环己-3-烯腈

CAS 100-45-8 MFCD00013778

化学结构图

100-45-8
SMILES: N#CC1CC=CCC1

化学属性

Mol. FormulaC7H9N
Mol. Weight107.16
Refractive index1.4720 to 1.4750
Flash Point66°C(lit.)
Boiling Point60°C/5.3mmHg
Solubility溶于部分有机溶剂。
Density0,96 g/cm3

别名和识别编码

Chemical NameCyclohex-3-Enecarbonitrile
MDL NumberMFCD00013778
CAS Number100-45-8
Synonym 1,2,3,6-TETRAHYDROBENZONITRILE 1,2,5,6-TETRAHYDROBENZONITRILE 1,2,5,6-TETRAHYDROBENZONITRILE 97% 1-CYANO-1-CYLCOHEXENE 1-Cyano-3-cyclohexene 3-CYANOCYCLOHEXENE 3-CYCLOHEXENE CARBONITRILE 3-CYCLOHEXENE-1-CARBONITRILE 3-CYCLOHEXENE-1-CARBOXYLIC ACID NITRILE 3-Cyclohexenecarbonitrile 3-Cyclohexenecyanide 3-Cyclohexenyl cyanide 3-Cyklohexenylkyanid 3-cyclohexenylcyanide 3-环己烯-1-腈 4-CYANO-1-CYCLOHEXENE 4-CYANO-1-CYCLOHEXENE 95+% 4-CYANOCYCLOHEXENE 4-CYANOCYCLOHEXENE-1 4-Cyanocyclohexene Cyclohex-3-enenitrile Cyclohexen-3-carbonitril TIMTEC-BB SBB007998 Tetrahydrobenzonitrile cyclohex-3-enenitrile
Reaxys-RN636074
PubChem Substance ID87565899
Chemical Name Translation环己-3-烯腈
Wiswesser Line NotationL6UTJ DCN
Beilstein Registry Number0636074
LabNetwork Molecule IDLN01313923
InChIInChI=1S/C7H9N/c8-6-7-4-2-1-3-5-7/h1-2,7H,3-5H2
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分类

  • {uni_hamburg} no charge; carbocycle; alicycle; 6RingOnly; 6ring; racemate; 1fragment

相关文献及参考

  • Short: IV/3 Title: Thermodynamic Equilibria of Boiling Mixtures Author: Weishaupt, J. Editor: Hausen, H. Source: Landolt-Börnstein, New Series Volume: IV/3 Year: 1975 ISBN: 3-540-07203-9 ISBN: 978-3-540-07203-4 Internet Resource: DOI:10.1007/b20006 RefComment: 636 figs., VIII, 376 pages. Hardcover Abstract: In the 6th Edition data on temperature, pressure,and the composition of liquids and vapor of boiling mixtures in thermodynamic equilibrium are contained in volumes II/2a and IV/4b. Volume IV/3 of the New Series supplements these tables, covering the literature from 1954 up to the beginning of 1974.

安全信息

RTECSGW2625000
Packing GroupIII
UN Number 3276
Signal word
Hazard statements
  • H227 Combustible liquid 可燃液体
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。
  • 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+P330
  • P302+P350
  • P302+P352+P332+P313+P362+P364
  • P304+P340+P311
  • P305+P351+P338+P337+P313
  • 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+
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
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；
  • 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；
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
Hazard Class6.1
GHS Symbol 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 9460 uL/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine.
   (Chicago, IL)  V.2-10, 1950-54. For publisher information, see AEHLAU.
   Volume(issue)/page/year: 10,61,1954

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 460 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine.
   (Chicago, IL)  V.2-10, 1950-54. For publisher information, see AEHLAU.
   Volume(issue)/page/year: 10,61,1954

TYPE OF TEST            : LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 124 ppm/4H
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine.
   (Chicago, IL)  V.2-10, 1950-54. For publisher information, see AEHLAU.
   Volume(issue)/page/year: 10,61,1954

其他信息

  • MOL 文件:100-45-8.mol
  • Sigma Aldrich:100-45-8(sigmaaldrich)
  • MSDS 信息:3-环己烯-1-腈(100-45-8).msds
  • 图谱信息:3-环己烯-1-腈(100-45-8)红外图谱(IR2) 3-环己烯-1-腈(100-45-8)核磁图( 1 HNMR) 3-环己烯-1-腈(100-45-8)红外图谱(IR1)
  • 外观性质:液体。
  • TCI Shanghai:4-氰基-1-环己烯 4-Cyano-1-cyclohexene,>;95.0%(GC)(100-45-8)
  • 3-环己烯-1-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 C0837 4-氰基-1-环己烯 4-Cyano-1-cyclohexene 5ML 1320元 2014/06/02 C0837 4-氰基-1-环己烯 4-Cyano-1-cyclohexene 25ML 3390元

系列性分类

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