Home Amines 117291-16-4
117291-16-4,MFCD11042652
Catalog No.:AA000DZS

117291-16-4 | Benzenepropanoic acid, 4-fluoro-β-[(2,2,2-trifluoroacetyl)amino]-

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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000DZS
Chemical Name:
Benzenepropanoic acid, 4-fluoro-β-[(2,2,2-trifluoroacetyl)amino]-
CAS Number:
117291-16-4
Molecular Formula:
C11H9F4NO3
Molecular Weight:
279.1877
MDL Number:
MFCD11042652
SMILES:
OC(=O)CC(c1ccc(cc1)F)NC(=O)C(F)(F)F
Properties
Computed Properties
 
Complexity:
337  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.8  

Downstream Synthesis Route

[1]EuropeanJournalofMedicinalChemistry,1992,vol.27,p.961-965

[2]BulletindelaSocieteChimiquedeFrance,1987,p.1079-1083

Literature
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Additional Info:
SDS
Tags:117291-16-4 Molecular Formula|117291-16-4 MDL|117291-16-4 SMILES|117291-16-4 Benzenepropanoic acid, 4-fluoro-β-[(2,2,2-trifluoroacetyl)amino]-