4-(4-Methoxyphenyl)-2-Butanone 4-(4-甲氧苯基)-2-丁酮

CAS 104-20-1 MFCD00008791

化学结构图

104-20-1
SMILES: COc1ccc(CCC(C)=O)cc1

化学属性

Mol. FormulaC11H14O2
Mol. Weight178.23
Density1.046
Boiling Point152-153 °C at 15 mmHg
Melting Point8 °C
Refractive index1.5180 to 1.5210
Flash Point100°C(lit.)
TSCAYes

别名和识别编码

Chemical Name4-(4-Methoxyphenyl)-2-Butanone
Synonym Anisylacetone {LY} Anisylacetone {} {LY} Anisylacetone {} {} {LY} Anisylacetone {} {} {} {LY} Anisylacetone {} {} {} {} {LY} Anisylacetone {} {} {} {} {} {LY} Anisylacetone {} {} {} {} {} {} {LY} Anisylacetone {} {} {} {} {} {} {} {LY} Anisylacetone {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {LY} Anisylacetone {} {} {} {} {} {} {} {} {} {LY} Anisylacetone {} {} {} {} {} {} {} {} {} {} {LY} Anisylacetone {} {} {} {} {} {} {} {} {} {} {} {LY} Anisylacetone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Anisylacetone {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Anisylacetone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Anisylacetone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Anisylacetone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Anisylacetone {} {} {} {} {} {} {} {} {} {} {}
Beilstein Registry Number1869592
PubChem Substance ID61007
CAS Number104-20-1
EC Number203-184-2
MDL NumberMFCD00008791
Reaxys-RN1869592
Chemical Name Translation4-(4-甲氧苯基)-2-丁酮
LabNetwork Molecule IDLN00224984
InChIInChI=1S/C11H14O2/c1-9(12)3-4-10-5-7-11(13-2)8-6-10/h5-8H,3-4H2,1-2H3
Canonical SMILESCC(CCC1=CC=C(C=C1)OC)=O
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分类

  • {SNA} Aloe Vera, Building Blocks, C11 to C12, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks, Phytochemicals by Plant (Food/Spice/Herb), 细胞生物学, 营养研究
  • {SNA} Aloe Vera, Building Blocks, C11 to C12, Carbonyl Compounds, Chemical Synthesis, Ketones, Nutrition Research, Organic Building Blocks, Phytochemical
  • {SNA} A-D, Alphabetical Listings, Certified Food Grade Products, Flavors and Fragrances, Halal Certified Products, I - N, Kosher Certified Products,

相关文献及参考

  • Arctander , 248 / FT-NMR 1 (2), 794:C / Fenaroli , 461 / RegBook 48 (2), 1617:E / RegBook 1 (2), 1617:E / Structure Index 1 , 252:D:5 / Vapor Phase 3 , 1222:A
  • Beil. 8 ,IV,506
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15
  • Short: IV/18B Title: Viscosity of Pure Organic Liquids and Binary Liquid Mixtures: Pure Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: IV/18B Year: 2001 Keyword: organic compounds; viscosity; liquids; mixtures Internet Resource: DOI:10.1007/b68240 RefComment: VII, 409 pages.

安全信息

WGK Germany2
RTECSEL9085500
Personal Protective Equipment Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US) Eyeshields, Gloves, half-mask respirator (EU), half-mask respirator (US), multi-purpose combination respirator cartridge (US) Eyeshields, Gloves
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触;
GHS Symbol
Precautionary statements
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛,皮肤或衣服。
Hazard Codes Xi
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           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 12,929,1974

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 12,929,1974

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

  • MSDS 信息:Anisylacetone(104-20-1).msds
  • 4-(4-甲氧苯基)-2-丁酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 M0756 4-(4-甲氧苯基)-2-丁酮 4-(4-Methoxyphenyl)-2-butanone 25ML 405元 2010/06/21 313980500 4-(4-甲氧苯基)-2-丁酮 4-(4-Methoxyphenyl)-2-butanone 98% 50 GR 868元 2010/06/21 313980050 4-(4-甲氧苯基)-2-丁酮 4-(4-Methoxyphenyl)-2-butanone 98% 5 GR 319元
  • FEMA:2672
  • Sigma Aldrich:104-20-1(sigmaaldrich)
  • Alfa Aesar:4-4-甲氧基苯基二丁酮,99% 4-(4-Methoxyphenyl)-2-butanone, 99%(104-20-1)
  • MOL 文件:104-20-1.mol
  • 用途一:多巴酚丁胺中间体。昆虫(如金龟子)的引诱剂。
  • TCI Shanghai:4-(4-甲氧苯基)-2-丁酮 4-(4-Methoxyphenyl)-2-butanone,>;96.0%(GC)(104-20-1)
  • Acros Organics:4-(4-甲氧基苯基)-2-丁酮 4-(4-Methoxyphenyl)-2-butanone, 98%(104-20-1)
  • 图谱信息:4-(4-甲氧苯基)-2-丁酮(104-20-1)核磁图( 13 CNMR) 4-(4-甲氧苯基)-2-丁酮(104-20-1)质谱(MS) 4-(4-甲氧苯基)-2-丁酮(104-20-1)红外图谱(IR1)

系列性分类


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