Home Fluorides 42916-66-5
42916-66-5,MFCD09031805
Catalog No.:AA0070QW

42916-66-5 | 1-4-(Trifluoromethylphenyl)pentan-1-one

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Purity
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Price(USD)
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250mg
98%
in stock  
$178.00   $125.00
- +
1g
98%
in stock  
$427.00   $299.00
- +
5g
98%
in stock  
$1,258.00   $881.00
- +
10g
98%
in stock  
$2,007.00   $1,405.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0070QW
Chemical Name:
1-4-(Trifluoromethylphenyl)pentan-1-one
CAS Number:
42916-66-5
Molecular Formula:
C12H13F3O
Molecular Weight:
230.2262
MDL Number:
MFCD09031805
SMILES:
CCCCC(=O)c1ccc(cc1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
227  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
4  
XLogP3:
3.9  

Downstream Synthesis Route

[1]Xia,Ying;Wang,Jianchun;Dong,Guangbin[JournaloftheAmericanChemicalSociety,2018,vol.140,#16,p.5347-5351]

[1]Metternich,JanB.;Artiukhin,DenisG.;Holland,MareikeC.;VonBremen-Kuhne,Maximilian;Neugebauer,Johannes;Gilmour,Ryan[JournalofOrganicChemistry,2017,vol.82,#19,p.9955-9977]

Literature
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SDS
Tags:42916-66-5 Molecular Formula|42916-66-5 MDL|42916-66-5 SMILES|42916-66-5 1-4-(Trifluoromethylphenyl)pentan-1-one