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Home Fluorides 2143-80-8
2143-80-8,MFCD01221416
Catalog No.:AA007QGL

2143-80-8 | (3E)-4-(2-Fluorophenyl)but-3-en-2-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$211.00   $148.00
- +
5g
97%
in stock  
$643.00   $450.00
- +
10g
97%
in stock  
$976.00   $683.00
- +
  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA007QGL
Chemical Name:
(3E)-4-(2-Fluorophenyl)but-3-en-2-one
CAS Number:
2143-80-8
Molecular Formula:
C10H9FO
Molecular Weight:
164.1763
MDL Number:
MFCD01221416
SMILES:
CC(=O)/C=C/c1ccccc1F
Properties
Computed Properties
 
Complexity:
186  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
2.1  

Literature

Title: Quantum chemical- and 3-D-QSAR (CoMFA) studies of benzalacetones and 1,1,1-trifluoro-4-phenyl-3-buten-2-ones.

Journal: Bioorganic & medicinal chemistry letters 20020902

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SDS
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Tags:2143-80-8 Molecular Formula|2143-80-8 MDL|2143-80-8 SMILES|2143-80-8 (3E)-4-(2-Fluorophenyl)but-3-en-2-one