Home Fluorides 321433-84-5
321433-84-5,MFCD00214844
Catalog No.:AA00IXF4

321433-84-5 | N-[(E)-2-(benzenesulfonyl)-2-nitroethenyl]-3-(trifluoromethyl)aniline

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Technical Information
Catalog Number:
AA00IXF4
Chemical Name:
N-[(E)-2-(benzenesulfonyl)-2-nitroethenyl]-3-(trifluoromethyl)aniline
CAS Number:
321433-84-5
Molecular Formula:
C15H11F3N2O4S
Molecular Weight:
372.3190
MDL Number:
MFCD00214844
SMILES:
[O-][N+](=O)/C(=C\Nc1cccc(c1)C(F)(F)F)/S(=O)(=O)c1ccccc1
Properties
Computed Properties
 
Complexity:
602  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
Undefined Bond Stereocenter Count:
1  
XLogP3:
4.3  

Literature
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SDS
Tags:321433-84-5 Molecular Formula|321433-84-5 MDL|321433-84-5 SMILES|321433-84-5 N-[(E)-2-(benzenesulfonyl)-2-nitroethenyl]-3-(trifluoromethyl)aniline