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Home Fluorides 117391-20-5
117391-20-5,MFCD24842761
Catalog No.:AA000E57

117391-20-5 | 2,2,2-Trifluoro-N-(3-oxo-2,3-dihydro-1H-inden-1-yl)acetamide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$411.00   $288.00
- +
100mg
95%
3 weeks  
$558.00   $390.00
- +
250mg
95%
3 weeks  
$745.00   $522.00
- +
500mg
95%
3 weeks  
$1,109.00   $777.00
- +
1g
95%
3 weeks  
$1,390.00   $973.00
- +
2.5g
95%
3 weeks  
$2,613.00   $1,829.00
- +
5g
95%
3 weeks  
$3,811.00   $2,668.00
- +
10g
95%
3 weeks  
$5,595.00   $3,917.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000E57
Chemical Name:
2,2,2-Trifluoro-N-(3-oxo-2,3-dihydro-1H-inden-1-yl)acetamide
CAS Number:
117391-20-5
Molecular Formula:
C11H8F3NO2
Molecular Weight:
243.1819
MDL Number:
MFCD24842761
SMILES:
O=C(C(F)(F)F)NC1CC(=O)c2c1cccc2
Properties
Computed Properties
 
Complexity:
340  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.7  

Downstream Synthesis Route

[1]Rault,Sylvain;Dallemagne,Patrick;Robba,Max[BulletindelaSocieteChimiquedeFrance,1987,#6,p.1079-1083]

[2]Quermonne;Dallemagne;Louchahi-Raoul;Pilo;Rault;Robba[EuropeanJournalofMedicinalChemistry,1992,vol.27,#9,p.961-965]

[3]Rault,S.;Pilo,J.C.;Dallemagne,P.;Foloppe,M.P.;Robba,M.[BulletindelaSocieteChimiquedeFrance,1990,#2,p.316-323]

[4]Luan,Feng;Cordeiro,M.NatáliaD.S.;Alonso,Nerea;García-Mera,Xerardo;Caamaño,Olga;Romero-Duran,FranciscoJ.;Yañez,Matilde;González-Díaz,Humberto[BioorganicandMedicinalChemistry,2013,vol.21,#7,p.1870-1879]

[5]CurrentPatentAssignee:NRGTHERAPEUTICS-WO2022/49377,2022,A1

Literature
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SDS
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Tags:117391-20-5 Molecular Formula|117391-20-5 MDL|117391-20-5 SMILES|117391-20-5 2,2,2-Trifluoro-N-(3-oxo-2,3-dihydro-1H-inden-1-yl)acetamide