4-Acetylpyridine 4-乙酰基吡啶

CAS 1122-54-9 MFCD00006433

化学结构图

1122-54-9
SMILES: CC(=O)c1ccncc1

化学属性

Mol. FormulaC7H7NO
Mol. Weight121
Density1.029
Refractive index1.5260 to 1.5320
Boiling Point214°C
Melting Point13-16
Flash Point104°C(lit.)
TSCAYes
Solubility不溶于水。
Appearance 浅黄色透明液体，沸点212℃，熔点13-16℃
Stability对光和空气敏感

别名和识别编码

Chemical Name4-Acetylpyridine
CAS Number1122-54-9
Alfabeta NameACETYLPYRIDINE 4-
MDL NumberMFCD00006433
Synonym Ethanone, 1-(4-pyridinyl)- Acetylpyridine,4- 4-acetyl-pyridine 甲基-4-吡啶基酮 1-(4-pyridinyl)-ethanon METHYL 4-PYRIDYL KETONE 4-ACETYLPYRIDINE 97+% 4-Acetylpyridine min.98%(GC) γ-Acetylpyridine 1-pyridin-4-yl-ethanone Pyridine, 4-acetyl- 4-ACETYLPYRIDINE 4-乙酰吡啶 gamma-Acetylpyridine 4-acetyl-pyridin 4-乙酰基吡啶
EC Number214-350-9
Beilstein Registry Number21(3/4)3533
PubChem Substance ID14282
Chemical Name Translation4-乙酰基吡啶
Reaxys-RN107629
Wiswesser Line NotationT6NJ DV1
LabNetwork Molecule IDLN00008394
InChIInChI=1S/C7H7NO/c1-6(9)7-2-4-8-5-3-7/h2-5H,1H3
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分类

  • {SNA} Building Blocks, C7, Chemical Synthesis, Heterocyclic Building Blocks, Pyridines
  • {uni_hamburg} no charge; nitrogen heterocycle; aromatic; 6RingOnly; 6ring; ketone; 1fragment

相关文献及参考

  • Short: III/20a
  • Beilstein:21(3/4)3533
  • Short: III/35B
  • Short: III/38B

安全信息

Warnings IRRITANT
Signal word
GHS Symbol
WGK Germany3
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 Wear suitable protective clothing 穿戴适当的防护服；
Risk Statements
  • R36/38 Irritating to eyes and skin 对眼睛和皮肤有刺激性
  • R22 Harmful if swallowed 吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
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。
  • P304+P340+P312
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • 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。
  • 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
  • P332+P313
  • P302+P352+P312+P362+P364
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • P305+P351+P338+P337+P313
  • P301+
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
  • H302+H312+H332
Personal Protective Equipment Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSOB5426000
Hazard Codes Xn Xi Xi,Xn
Storage condition 充氩储存 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1400 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: 14,551,1971

TYPE OF TEST            : Gene conversion and mitotic recombination
TEST SYSTEM             : Yeast - Saccharomyces cerevisiae
DOSE/DURATION           : 9900 ppm
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 163,23,1986

TYPE OF TEST            : Sex chromosome loss and nondisjunction
TEST SYSTEM             : Yeast - Saccharomyces cerevisiae
DOSE/DURATION           : 6200 ppm
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 163,23,1986

其他信息

  • MOL 文件:1122-54-9.mol
  • 储运特性:库房通风低温干燥
  • 急性毒性:腹腔-小鼠 LD50: 1400 毫克/公斤
  • 毒性分级:中毒
  • color:brown-yellowish
  • Sigma Aldrich:1122-54-9(sigmaaldrich)
  • F:8
  • 不溶于水。
  • 类别:易燃液体
  • Hazard Note:Irritant
  • TCI Shanghai:4-乙酰吡啶 4-Acetylpyridine,>;98.0%(GC)(T)(1122-54-9)
  • 可燃性危险特性:可燃; 加热分解释放有毒氮氧化物烟雾
  • 灭火剂:干粉、泡沫、砂土、二氧化碳, 雾状水
  • MSDS 信息:Methyl 4-pyridyl ketone(1122-54-9).msds
  • 图谱信息:4-乙酰吡啶(1122-54-9)核磁图( 13 CNMR) 4-乙酰吡啶(1122-54-9)核磁图( 1 HNMR) 4-乙酰吡啶(1122-54-9)质谱(MS) 4-乙酰吡啶(1122-54-9)红外图谱(IR1)
  • 下游产品:1-(3-氨基-2-氯-4-吡啶基)-乙酮 --> 4-乙醇基吡啶 --> 1-（3-氨基-4-吡啶基）乙酮 --> 2-羰基-2-(吡啶-4-基)乙酸乙酯 --> 4-(溴乙酰基)吡啶氢溴酸盐
  • Alfa Aesar:4-乙酰基吡啶,98% 4-Acetylpyridine, 98%(1122-54-9)
  • 4-乙酰吡啶价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 A0113 4-乙酰吡啶 4-Acetylpyridine 250G 2590元 2014/06/02 A0113 4-乙酰吡啶 4-Acetylpyridine 25G 500元 2010/06/21 102705000 4-乙酰吡啶 4-Acetylpyridine 98% 500 GR 2790元
  • 海关编码:29333999
  • Acros Organics:4-乙酰基吡啶 4-Acetylpyridine, 98%(1122-54-9)

系列性分类

  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Alphabetic - Analytical Standards
  4. A - Alphabetic
  5. AA to AL - A
  1. C7 to C8 - Pyridines
  1. C6
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Pyridines 吡啶