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Home Amines 21045-62-5
21045-62-5,MFCD00115108
Catalog No.:AA002KQ9

21045-62-5 | 4-Diethylamino-1,1,1-trifluorobut-3-en-2-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
96%
in stock  
$77.00   $54.00
- +
5g
96%
in stock  
$271.00   $190.00
- +
10g
96%
in stock  
$502.00   $352.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002KQ9
Chemical Name:
4-Diethylamino-1,1,1-trifluorobut-3-en-2-one
CAS Number:
21045-62-5
Molecular Formula:
C8H12F3NO
Molecular Weight:
195.1822
MDL Number:
MFCD00115108
SMILES:
CCN(C=CC(=O)C(F)(F)F)CC
Properties
Computed Properties
 
Complexity:
194  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
4  
XLogP3:
2.2  

Downstream Synthesis Route

[1]Amon,CatherineM.;Banwell,MartinG.;Gravatt,G.Lance[JournalofOrganicChemistry,1987,vol.52,#22,p.4851-4855]

[1]JournalofOrganicChemistryUSSR(EnglishTranslation),1990,vol.26,p.1623-1628    ZhurnalOrganicheskoiKhimii,1990,vol.26,p.1877-1883

[2]JournalofPhysicalOrganicChemistry,2007,vol.20,p.190-200

Literature
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Additional Info:
SDS
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Tags:21045-62-5 Molecular Formula|21045-62-5 MDL|21045-62-5 SMILES|21045-62-5 4-Diethylamino-1,1,1-trifluorobut-3-en-2-one