4'-Aminoacetophenone 4’-氨基苯乙酮

CAS 99-92-3 MFCD00007896

化学结构图

99-92-3
SMILES: CC(=O)c1ccc(N)cc1

化学属性

Mol. FormulaC8H9NO
Mol. Weight135.16
Boiling Point293°C at 760 mmHg
Melting Point103-107°C
TSCAYes
Density1.451
Stability对湿度敏感
Flash Point292-294°C
Appearance 黄色针状结晶。熔点106℃，沸点293-295℃，195-200℃（2kPa）。易溶于热水，溶于醇、醚稀盐酸和稀硫酸，微溶于苯、冷水。有特殊愉快香味。

别名和识别编码

Chemical Name4’-Aminoacetophenone
CAS Number99-92-3
Alfabeta NameAMINOACETOPHENONE 4-'
MDL NumberMFCD00007896
EC Number202-801-2
Beilstein Registry Number471493
Reaxys-RN471493
PubChem Substance ID7468
Merck Number413
Chemical Name Translation4’-氨基苯乙酮
Wiswesser Line NotationZR DV1
LabNetwork Molecule IDLN00195171
Synonym 4'-Aminoacetophenone {LY} 4'-Aminoacetophenone 4-aminoacetophenone p-aminoacetophenone para-aminoacetophenone {} {LY} 4'-Aminoacetophenone {} {} {LY} 4'-Aminoacetophenone {} {} {} {LY} 4'-Aminoacetophenone {} {} {} {} {LY} 4'-Aminoacetophenone {} {} {} {} {} {LY} 4'-Aminoacetophenone {} {} {} {} {} {} {LY} 4'-Aminoacetophenone {} {} {} {} {} {} {} {LY} 4'-Aminoacetophenone {} {} {} {} {} {} {} {} {LY} 4'-Aminoacetophenone {} {} {} {} {} {} {} {} {} {LY} 4'-Aminoacetophenone {} {} {} {} {} {} {} {} {} {} {LY} 4'-Aminoacetophenone {} {} {} {} {} {} {} {} {} {} {} {LY} 4'-Aminoacetophenone {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4'-Aminoacetophenone {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4'-Aminoacetophenone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4'-Aminoacetophenone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4'-Aminoacetophenone {} {} {} {} {} {} {} {} {} {} {} {} {
InChIInChI=1S/C8H9NO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,9H2,1H3
Canonical SMILESCC(C1=CC=C(N)C=C1)=O
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分类

  • Analytical Reagents, Analytical/Chromatography, Spectroscopy, UV/Vis Reagents, UV/Visible (UV/VIS) Spectroscopy
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ketone; 1fragment
  • {SNA} Building Blocks, C7 to C8, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks

产品应用

  • 测定钯和维生素B1。铈的光度测定试剂。磺胺类比色测定。

相关文献及参考

  • Chen, Y., et al.: J. Bacteriol., 170, 781 (1988),
  • Short: II/27B
  • Donoghue, N., et al.: Eur. J. Biochem., 60, 1 (1975),
  • Beilstein:14,46
  • Beil. 14 ,IV,100

安全信息

Warnings IRRITANT-HARMFUL
GHS Symbol
WGK Germany3
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • 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
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Hazard Codes Xn Xn,Xi
RTECSAM5500000
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。
  • P264+P265
  • 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
  • P301+P317
  • P302+P352
  • P302+P352+P332+P313+P362+P364
  • P304+P340
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P317
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • P332+P317
  • P337+P317
  • 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
  • P362+P364
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Warning
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
  • 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
Storage condition 2-8°C, protect from light {LY} 2-8°C, protect from light {} {LY} 2-8°C, protect from light {} {} {LY} 2-8°C, protect from light {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 596 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GEPHDP General Pharmacology.  (Pergamon Press Inc., Maxwell House, Fairview
   Park, Elmsford, NY 10523) V.6-    1975-  Volume(issue)/page/year:
   14,465,1983

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 300 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: AD277-689

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 381 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GEPHDP General Pharmacology.  (Pergamon Press Inc., Maxwell House, Fairview
   Park, Elmsford, NY 10523) V.6-    1975-  Volume(issue)/page/year:
   14,465,1983

TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : M

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 260 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 80,31,1944

其他信息

  • 用途二:用作测定钯的灵敏试剂及测定维生素B1的试剂
  • 4-氨基苯乙酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 30006013 4-氨基苯乙酮;对氨基苯乙酮;对乙酰苯胺;对氨基乙酰苯;对氨基苯基甲基酮 10g 71元 2011/04/16 A0251 4'-氨基苯乙酮 4'-Aminoacetophenone 500G 2600元 2011/04/16 A0251 4'-氨基苯乙酮 4'-Aminoacetophenone 25G 320元
  • 有特殊气味。见光后色变深。溶于热水、醇、醚的盐酸，微溶于冷水和苯。半数致死量(大鼠，经口)381mg/kg。对眼睛、呼吸系统、皮肤有刺激性。
  • 储运特性:库房通风低温干燥
  • 上游原料:乙醇 --> 氨基苯 --> 氯化锌 --> 氯化亚锡 --> 对硝基苯乙酮 --> N-乙酰苯胺 --> 2-苯甲酰乙酰苯胺 --> 脱色炭
  • Sigma Aldrich:99-92-3(sigmaaldrich)
  • 可燃性危险特性:可燃;燃烧产生有毒氮氧化物烟雾
  • MSDS 信息:4-Aminoacetophenone(99-92-3).msds
  • 方法一:（1）由对硝基苯乙酮还原：将氯化亚锡、浓盐酸放入反应罐，冷却，搅拌加入对硝基苯乙酮。自然升温至90℃时，急冷至85℃，继续冷至室温，搅拌1h，过滤，滤饼加过量氢氧化钠溶液分解复合物。过滤，得对氨基苯乙酮粗品，用稀乙醇时得重结晶可得熔点105-106℃的精品。收率61%用铁粉和氯化钠代替氯化亚锡也可进行还原反应。（2）由乙酰苯胺、乙酐制得乙酰氨基苯乙酮，再水解、中和而得。乙酐、乙酰苯、无水氯化锌混合保持微沸5h，稍冷，倒入浓盐酸，回流水解5h，放置至室温，加入25%氢氧化钠至调节pH为7-8，通入蒸汽赶去苯胺，加脱色炭过滤，减压浓缩，冷却得橙黄色结晶。滤干得粗品。再用水进行重结晶提纯。
  • 用途三:医药喘咳素的中间体。也用于测定钯和维生素B1。
  • Alfa Aesar:4－氨基苯乙酮,99% 4'-Aminoacetophenone, 99%(99-92-3)
  • 用途一:用作医药喘咳素的原料
  • 海关编码:29223900
  • 图谱信息:4-氨基苯乙酮(99-92-3)红外图谱(IR1) 4-氨基苯乙酮(99-92-3)核磁图( 13 CNMR) 4-氨基苯乙酮(99-92-3)核磁图( 1 HNMR) 4-氨基苯乙酮(99-92-3)红外图谱(IR3) 4-氨基苯乙酮(99-92-3)Raman光谱 4-氨基苯乙酮(99-92-3)红外图谱(IR2) 4-氨基苯乙酮(99-92-3)质谱(MS)
  • 类别:农药
  • 用途四:测定钯和维生素B1。铈的光度测定试剂。磺胺类比色测定。
  • 急性毒性:口服-大鼠LD50: 381 毫克/公斤; 口服-小鼠LD50: 596 毫克/公斤
  • TSCA:T
  • Acros Organics:4'-氨基苯乙酮 4'-Aminoacetophenone, 99%(99-92-3)
  • 下游产品:对羟基苯乙酮 --> 4-咪唑乙酰苯酮 --> 直接红 23 --> 4-(1H-吲哚-2-基)苯胺 --> 4-碘代苯乙酮 --> 3,5-二氯-4-氨基苯乙酮 --> 醋磺环已脲 --> 喘敌素
  • 毒性分级:高毒
  • 灭火剂:干粉、泡沫、砂土、二氧化碳, 雾状水
  • TCI Shanghai:4'-氨基苯乙酮 4'-Aminoacetophenone,>;98.0%(T)(99-92-3)
  • MOL 文件:99-92-3.mol

系列性分类

  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Reagents
  3. Spectroscopy - Analytical Reagents
  4. UV/Visible (UV/VIS) Spectroscopy - 紫外/可见吸收光谱
  5. UV/Vis Reagents - UV/Visible (UV/VIS) Spectroscopy
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Ketones - Carbonyl Compounds
  6. C7 to C8 - Ketones
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Ketones - Carbonyl Compounds
  6. C7 to C8 - Ketones
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Chromatography - Analytical Standards
  4. Environmental Standards - Chromatography
  5. Volatiles/ Semivolatiles - Environmental Standards
  6. Alpha Sort - Volatiles/ Semivolatiles
  7. A-B - Alpha Sort
  1. Analytical & Chromatography 分析化学与色谱
  2. HPLC
  3. Analytical Reagents
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Ketones 酮
  6. C3 to C6

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