1-(4-fluorophenyl)but-1-en-3-one 4-(4-氟苯基)-3-丁烯-2-酮

CAS 1611-38-7 MFCD00205144

化学结构图

1611-38-7
SMILES: CC(=O)C=Cc1ccc(F)cc1

化学属性

Mol. FormulaC10H9FO
Mol. Weight164.18
Boiling Point119°/2.5mm
Melting PointBP: 119 @ 2mm Hg

别名和识别编码

Chemical Name1-(4-fluorophenyl)but-1-en-3-one
CAS Number1611-38-7
Alfabeta NameFLUOROPHENYLBUTENONE 4432()------
MDL NumberMFCD00205144
Synonym 1-(4-fluorophenyl)but-1-en-3-one
Chemical Name Translation4-(4-氟苯基)-3-丁烯-2-酮
PubChem Substance ID2737469
InChIInChI=1S/C10H9FO/c1-8(12)2-3-9-4-6-10(11)7-5-9/h2-7H,1H3
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分类

  • {SNA} Alkenyl Fluorinated Building Blocks, Building Blocks, Chemical Synthesis, Fluorinated Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks
  • {KO} Ketones

安全信息

Warnings IRRITANT
WGK Germany3
GHS Symbol
Signal word Warning
Hazard statements
  • H302 Harmful if swallowed 吞食有害
Hazard Codes Xn
Risk Statements
  • R22 Harmful if swallowed 吞咽有害

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Acceptors
1
Rotatable Bonds
3
H-bond Donors
0
LogP
1

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Fluorinated Building Blocks 氟化物砌块
  4. Organic Fluorinated Building Blocks - Fluorinated Building Blocks
  5. Other Fluorinated Organic Building Blocks - Organic Fluorinated Building Blocks
  6. Alkenyl Fluorinated Building Blocks - Other Fluorinated Organic Building Blocks
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Halogenated 卤化物 (氟氯溴碘)
  5. Fluoro 氟化物

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