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Home Fluorides 86571-26-8
86571-26-8,MFCD16615390
Catalog No.:AA004UHW

86571-26-8 | 1,1,1-TRIFLUORO-4-PHENYLBUTAN-2-ONE

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
2 weeks  
$251.00   $176.00
- +
5g
97%
2 weeks  
$898.00   $629.00
- +
10g
97%
2 weeks  
$1,596.00   $1,117.00
- +
  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA004UHW
Chemical Name:
1,1,1-TRIFLUORO-4-PHENYLBUTAN-2-ONE
CAS Number:
86571-26-8
Molecular Formula:
C10H9F3O
Molecular Weight:
202.1731
MDL Number:
MFCD16615390
SMILES:
O=C(C(F)(F)F)CCc1ccccc1
Properties
Computed Properties
 
Complexity:
192  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
3  
XLogP3:
3  

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:86571-26-8 Molecular Formula|86571-26-8 MDL|86571-26-8 SMILES|86571-26-8 1,1,1-TRIFLUORO-4-PHENYLBUTAN-2-ONE