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10075-06-6,MFCD28714602
Catalog No.:AA0002PV

10075-06-6 | 2-Butenoic acid, 4,4,4-trifluoro-3-phenyl-, ethyl ester

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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0002PV
Chemical Name:
2-Butenoic acid, 4,4,4-trifluoro-3-phenyl-, ethyl ester
CAS Number:
10075-06-6
Molecular Formula:
C12H11F3O2
Molecular Weight:
244.2097
MDL Number:
MFCD28714602
SMILES:
CCOC(=O)C=C(C(F)(F)F)c1ccccc1
Properties
Computed Properties
 
Complexity:
289  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
4  
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.7  

Downstream Synthesis Route
383-63-1    7396-44-3    591-51-5   
(E)-benzylγ,γ,γ-trifluoro-β-phenylcrotonate 
 
(Z)-benzylγ,γ,γ-trifluoro-β-phenylcrotonate 
  10075-06-6 

[1]Tetrahedron,2015,vol.71,p.8059-8066

Literature
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SDS
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Tags:10075-06-6 Molecular Formula|10075-06-6 MDL|10075-06-6 SMILES|10075-06-6 2-Butenoic acid, 4,4,4-trifluoro-3-phenyl-, ethyl ester