Phenylacetone 苯基丙酮(1-苯基-丙酮)

CAS 103-79-7 MFCD00017249

化学结构图

103-79-7
SMILES: CC(=O)Cc1ccccc1

化学属性

Mol. FormulaC9H10O
Mol. Weight134.19
Density1.015
Boiling Point216 ºC
Refractive index1.5155-1.5175
Flash Point83 ºC
Melting Point-15 ºC
Solubility不溶
Appearance 1.516,相对密度1.0030,不溶于水,溶于醇、丙酮、苯等有机溶剂。 本品为黄色液体,b.p.214~216℃(86~87℃/13.4kPa),n D 20

别名和识别编码

Chemical NamePhenylacetone
CAS Number103-79-7
Synonym 1-PHENYL-2-PROPANONE BENZYL METHYL KETONE phenylpropan-2-one 1-Phenyl-2-propanone Methyl benzyl ketone 苄基丙酮,苯基-2-丙酮,苄基甲基酮 2-Propanone,1-phenyl- 苯基甲酮 苄基甲基酮 苯基-2-丙酮 1—苯基—2—丙酮 Benaylmethyldetone Phenylmethyl methyl ketone PHENYL-2-PROPANONE 甲基苄基酮 2-Propanone, 1-phenyl- benzylacetone 苄基甲基酮 PHENYLACETONE 1-苯基-2-丙酮 Phenylaceton P2P alpha-Phenylacetone Benzyl-methylketon a-Phenylacetone Benzylmethylketon 苯基丙酮 3-phenylpropan-2-one 苯乙酮(030707需海运) 1-PHENYLACETONE Methylbenzylketon α-Phenylacetone 3-Phenyl-2-propanone methylbenzylketone 苯丙酮(限出口) 1-phenyl-2-propanon phenylmethylmethylketone 1-Phenylpropan-2-on PHENYLACETONE METHANOL SOLUTION Fenproporex-M (desamino-oxo-) 1-phenyl-propan-2-one Benzyl methyl ketone phenyl-acetone 1-Phenyl-2-propanone; Phenyl-2-propanone; Benzyl methyl ketone 1-Phenyl-2-propanon Benzyl methyl ketone 98.5+ % (GLC) Phenylacetone 1-Phenylacetone 丙酮苯
MDL NumberMFCD00017249
Beilstein Registry Number742120
EC Number203-144-4
Chemical Name Translation苯基丙酮(1-苯基-丙酮)
Wiswesser Line Notation1V1R
PubChem Substance ID7678
InChIInChI=1S/C9H10O/c1-8(10)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3
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分类

  • {Chemicalbook} 农药中间体: 杀鼠剂中间体
  • Pharmaceuticals
  • Intermediates & Fine Chemicals
  • Aromatics
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ketone; 1fragment
  • Metabolites & Impurities

产品应用

  • A metabolite of Lisdexamfetamine dimesylate.

相关文献及参考

  • Cody, J., et al.: J. Anal. Toxicol., 27, 485
  • Short: II/27B Title: Diamagnetic Susceptibility of Organic Compounds, Oils, Paraffins and Polyethylenes Author: Kumar, M.; Gupta, R. Editor: Gupta, Radha Raman Source: Landolt-Börnstein, New Series Volume: II/27B Year: 2008 Keyword: diamagnetic susceptibility; organic compounds ISBN: 978-3-540-44359-9 (print) ISBN: 978-3-540-45860-9 (online) Internet Resource: doi:10.1007/978-3-540-45860-9 RefComment: VIII, 503 p. With CD-ROM., Hardcover RefComment: Written for: Scientists and researchers in the fields of physics, chemistry, materials science RefComment: Supplement and Revised Editon to II/16 Abstract: The volume II/27 has been divided into three subvolumes according to the classes of compounds: Subvolume A: Diamagnetic susceptibility and magnetic anisotropy of inorganic and organometallic compounds; Subvolume B: Diamagnetic susceptibility of organic compounds, oils, paraffins and polyethylenes; Subvolume C: Diamagnetic susceptibility and magnetic anisotropy of organic compounds. The data presented in this volume are based on the literature survey of the chemical abstracts up to 2005. The calculated values of diamagnetic susceptibility of organic compounds in the present subvolume II/27B are presented along with their experimental values. They have been calculated with the use of structural parameters in structural formula by using different theoretical methods available in the literature.
  • Short: II/5 Title: Molecular Acoustics Author: Schaaffs, W. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: II/5 Year: 1967 ISBN: 3-540-03897-3 ISBN: 978-3-540-03897-9 Internet Resource: DOI:10.1007/b19950 RefComment: 321 figs., XII, 286 pages, Hardcover
  • Short: III/35C1 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Hydrogen-1, Part 1: Aliphatic and Aromatic Hydrocarbons, Steroids, Carbohydrates Author: Gu

安全信息

GHS Symbol
Precautionary statements
  • P301+P310
Hazard statements
  • H301 Toxic if swallowed 吞食有毒
WGK Germany3
RTECSUC3500100
Personal Protective Equipment Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US)
Signal word Danger
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触;
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 540 mg/kg
TOXIC EFFECTS :
   Behavioral - ataxia
   Behavioral - antipsychotic
REFERENCE :
   JPMSAE Journal of Pharmaceutical Sciences.  (American Pharmaceutical Assoc.,
   2215 Constitution Ave., NW, Washington, DC 20037)  V.50-    1961-
   Volume(issue)/page/year: 60,799,1971

Restrict 易制毒

其他信息

  • 用途一:用作有机中间体,用于合成敌鼠钠盐;医药中间体,用于合成苯丙胺、苯基异丙胺等
  • MSDS 信息:Phenylacetone(103-79-7).msds
  • Acros Organics:苯丙酮(限出口) Phenylacetone,99+%(103-79-7)
  • 用途四:该品为有机合成中间体,用于杀鼠剂敌鼠钠的生产。
  • 方法二:由苯乙酸与乙酐反应而得。
  • Sigma Aldrich:103-79-7(sigmaaldrich)
  • MOL 文件:103-79-7.mol
  • 用途三:1-苯基-2-丙酮是杀鼠剂敌鼠、氯鼠酮的中间体。
  • 下游产品:过氧化二苯甲酰 --> 乙酰胺 --> 敌鼠 --> 苯亚甲基丙酮 --> 安非他酮 --> 1,1-二苯基丙酮 --> 甲氧那明 --> 1-溴-1-苯基-2-丙酮 --> 1-(4-氯苯基)-1-苯基丙酮
  • 用途二:用于合成敌鼠钠盐等农药中间体,苯丙胺、苯基异丙胺等医药中间体
  • 上游原料:苯甲醛 --> 苯乙酸 --> 2-氯丙酸甲酯
  • 苯基丙酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/06/21 159195000 苯基丙酮 Phenylacetone 99+% 500 GR 1031元 2010/06/21 159191000 苯基丙酮 Phenylacetone 99+% 100 GR 823元
  • 方法一:其制备方法是将苯甲醛与2-氯丙酸甲酯反应,然后水解、脱羧得到粗产品,在水溶液中调节pH=6,用乙酸乙酯萃取,水相用25%K 2 CO 3 溶液处理至pH=6,再用乙酸乙酯处理,然后蒸馏粗产品得产品。

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