3-Chloro-1-phenylpropan-1-one 3'-氯代苯丙酮

CAS 936-59-4 MFCD00000990

化学结构图

936-59-4
SMILES: O=C(CCCl)c1ccccc1

化学属性

Mol. FormulaC9H9ClO
Mol. Weight168.62
Density1.422
Flash Point>110°(230°F)
TSCAYes
Boiling Point113-115 °C at 4 mmHg
Melting Point48-50 °C
Solubility不溶

别名和识别编码

Chemical Name3-Chloro-1-phenylpropan-1-one
CAS Number936-59-4
Synonym 3-Chloropropiophenone {LY} 3-Chloropropiophenone {} {LY} 3-Chloropropiophenone {} {} {LY} 3-Chloropropiophenone {} {} {} {LY} 3-Chloropropiophenone {} {} {} {} {LY} 3-Chloropropiophenone {} {} {} {} {} { {} {} {} {} {} {LY} 3-Chloropropiophenone {} {} {} {} {} {} {LY} 3-Chloropropiophenone {} {} {} {} {} {} {} {LY} 3-Chloropropiophenone {} {} {} {} {} {} {} {} {LY} 3-Chloropropiophenone {} {} {} {} {} {} {} {} {} {LY} 3-Chloropropiophenone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloropropiophenone {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloropropiophenone {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloropropiophenone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloropropiophenone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloropropiophenone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloropropiophenone {} {} {} {} {} {} {} {} {} {} {} {
EC Number213-317-6
Beilstein Registry Number2043580
MDL NumberMFCD00000990
PubChem Substance ID70295
Reaxys-RN2043580
Chemical Name Translation3'-氯代苯丙酮
InChIKeyKTJRGPZVSKWRTJ-UHFFFAOYSA-N
LabNetwork Molecule IDLN00227079
InChIInChI=1S/C9H9ClO/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5H,6-7H2
Canonical SMILESO=C(C1=CC=CC=C1)CCCl
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分类

  • {SNA} Building Blocks, C9, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks
  • Intermediates
  • Aromatics
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ketone; 1fragment
  • Impurities

产品应用

  • 3-Chloropropiophenone is an impurity of Fluoxetine (F597100).

相关文献及参考

  • Short: EINECS
  • Wirth, D.D. et al.: Chromatographia, 46, 511 (1997); Lacroix, P.M. et al.: J. AOAC Int., 78, 334 (1995);
  • Short: III/20b
  • Precursor of phenyl vinyl ketone.

安全信息

Signal word Warning
GHS Symbol
WGK Germany3
Safety Statements
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
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。
  • 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
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • 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
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛,皮肤或衣服。
  • P305+P351+P338+P337+P313
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Hazard Codes Xi
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
Storage condition 2-8°C {LY} 2-8°C Store at room temperature {} {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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°

其他信息

  • MOL 文件:936-59-4.mol
  • Acros Organics:3-氯苯丙酮 3-Chloropropiophenone, 95%(936-59-4)
  • 图谱信息:3-氯代苯丙酮(936-59-4)核磁图( 13 CNMR) 3-氯代苯丙酮(936-59-4)红外图谱(IR2) 3-氯代苯丙酮(936-59-4)红外图谱(IR1) 3-氯代苯丙酮(936-59-4)质谱(MS) 3-氯代苯丙酮(936-59-4)核磁图( 1 HNMR)
  • 3-氯代苯丙酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 C0995 3-氯苯丙酮 3-Chloropropiophenone 25G 220元 2010/06/21 369980500 3-氯代苯丙酮 3-Chloropropiophenone 90%, tech. 50 GR 1884元 2010/06/21 369980100 3-氯代苯丙酮 3-Chloropropiophenone 90%, tech. 10 GR 565元
  • 用途二:医药中间体,也可用于其他有机合成
  • MSDS 信息:3-Chloro-1-phenyl-1-propanone(936-59-4).msds
  • 下游产品:4,7-二苯基-1,10-菲罗啉
  • Alfa Aesar:3-氯苯丙酮,96% 3-Chloropropiophenone, 96%(936-59-4)
  • Sigma Aldrich:936-59-4(sigmaaldrich)
  • TCI Shanghai:3-氯苯丙酮 3-Chloropropiophenone,>;96.0%(GC)(936-59-4)
  • 用途一:用于合成药物安非他酮

系列性分类