4-Acetoxyphenyl-2-Butanone 4-(3-氧基丁基)苯基乙酸酯

CAS 3572-06-3 MFCD00008704

化学结构图

3572-06-3
SMILES: CC(=O)CCc1ccc(OC(C)=O)cc1

化学属性

Mol. FormulaC12H14O3
Mol. Weight206.24
Density1.099
Boiling Point352.6 °C at 760 mmHg
Refractive index1.5070 to 1.5110
Flash Point>110 ºC
Appearance 淡黄色液体，密度 1.099，沸点 123-124 ℃(0.2mmHg)，闪点 >;110 ℃

别名和识别编码

Chemical Name4-Acetoxyphenyl-2-Butanone
CAS Number3572-06-3
MDL NumberMFCD00008704
Synonym Cue-lure {LY} Cue-lure {} {LY} Cue-lure {} {} {LY} Cue-lure {} {} {} {LY} Cue-lure {} {} {} {} {LY} Cue-lure {} {} {} {} {} {LY} Cue-lure {} {} {} {} {} {} {LY} Cue-lure {} {} {} {} {} {} {} {LY} Cue-lure {} {} {} {} {} {} {} {} {LY} Cue-lure {} {} {} {} {} {} {} {} {} {LY} Cue-lure {} {} {} {} {} {} {} {} {} {} {LY} Cue-lure {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Cue-lure {} {} {} {} {} {} {} {} {} {} {} {} {LY} Cue-lure {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Cue-lure {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Cue-lure {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Cue-lure {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Cue-lure {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Cue-lure {} {} {} {} {} {} {} {} {} {} {} {}
PubChem Substance ID19137
Beilstein Registry Number1961620
EC Number222-682-0
Reaxys-RN1961620
Merck Number2616
Chemical Name Translation4-(3-氧基丁基)苯基乙酸酯
Wiswesser Line Notation1VOR D2V1
LabNetwork Molecule IDLN00196179
InChIInChI=1S/C12H14O3/c1-9(13)3-4-11-5-7-12(8-6-11)15-10(2)14/h5-8H,3-4H2,1-2H3
Canonical SMILESCC(OC1=CC=C(CCC(C)=O)C=C1)=O
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分类

  • {Chemicalbook} 食品添加剂: 食用香料（增香剂）: 天然等同香料和人造香
  • {SNA} A-F, Analytical Standards, Analytical/Chromatography, Chemical Class, Chromatography, Food & Beverage Standards, Ketone, Ketones, 化合物分类, 按字母排序, 香精香料
  • {
  • {SNA} A-F, A-L,
  • {SNA} A-F, Analytical Standards, Chemical Class, Chromatography,
  • {SNA} A - D, A-B, A-D, Alphabetical Listings, Flavors and Fragrances, Halal Certified Products, Kosher Certified Products
  • {SNA} Building Blocks, C12 to C63, Carbonyl Compounds, Chemical S

安全信息

WGK Germany2
RTECSEL8950000
Personal Protective Equipment Eyeshields, Gloves
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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
Signal word Warning
Hazard statements
  • H303 May be harmfully swallowed 吞食可能有害
Precautionary statements
  • P273 Avoid release to the environment. 避免释放到环境中。
  • 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。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard Codes Xi
GHS Symbol
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
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : >2025 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   31,421,1975

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 3038 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   31,421,1975

TYPE OF TEST            : LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >2800 mg/m3
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   31,421,1975

其他信息

  • 用途一:用于瓜小实蝇的性引诱剂
  • Sigma Aldrich:3572-06-3(sigmaaldrich)
  • 使用限量:FEMA(mg/kg)：糖果、胶冻、布丁，2.0；无醇饮料0.5；水果冰品、糖霜、蜜饯、果酱、果冻、代乳品，1.0；胶姆糖10.0。
  • 可燃性危险特性:可燃;加热分解释放刺激烟雾
  • 乙酸覆盆子酮酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 A2368 4-(4-乙酰氧基苯基)-2-丁酮 4-(4-Acetoxyphenyl)-2-butanone 25G 678元
  • 毒性分级:中毒
  • FEMA:3652
  • 灭火剂:干粉、泡沫、砂土和水
  • MOL 文件:3572-06-3.mol
  • 参考质量标准:FAO/WHO，2000 含量(GT-10-4) ≥93%(邻、对异构体之和应占95%以上) 邻位异构体 2%～5% 折射率(n D 20 ) 1.506～1.512 相对密度(d 25 25 ) 1.096～1.100
  • Hazard Note:Irritant
  • MSDS 信息:4-(4-Acetoxyphenyl)-2-butanone(3572-06-3).msds
  • 储运特性:库房通风低温干燥
  • 类别:有毒物品
  • 急性毒性:口服-大鼠LD50:3038毫克/公斤; 吸入-大鼠 LC50: >;2800 毫克/立方米
  • 毒性:GRAS(FEMA)。

系列性分类

  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. Esters - Carbonyl Compounds
  6. C12 to C63 - Esters
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Chromatography - Analytical Standards
  4. Environmental Standards - Chromatography
  5. Pesticides & Metabolites - Environmental Standards
  6. Pesticides - Pesticides & Metabolites
  7. Others - Pesticides
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Chromatography - Analytical Standards
  4. Food & Beverage Standards - Chromatography
  5. Nutraceuticals - Food & Beverage Standards
  6. Flavors and Fragrances - Nutraceuticals
  7. A-F - Flavors and Fragrances
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Chromatography - Analytical Standards
  4. Food & Beverage Standards - Chromatography
  5. Nutraceuticals - Food & Beverage Standards
  6. Flavors and Fragrances - Nutraceuticals
  7. Substance Classification - Flavors and Fragrances
  8. Keton - Substance Classification

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