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477867-64-4,MFCD00793756
Catalog No.:AA00IOCD

477867-64-4 | 2-(4-methoxyphenyl)-2-[3-(trifluoromethyl)quinoxalin-2-yl]acetonitrile

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Technical Information
Catalog Number:
AA00IOCD
Chemical Name:
2-(4-methoxyphenyl)-2-[3-(trifluoromethyl)quinoxalin-2-yl]acetonitrile
CAS Number:
477867-64-4
Molecular Formula:
C18H12F3N3O
Molecular Weight:
343.3026
MDL Number:
MFCD00793756
SMILES:
N#CC(c1nc2ccccc2nc1C(F)(F)F)c1ccc(cc1)OC
Properties
Computed Properties
 
Complexity:
496  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
7  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
3.5  

Literature
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SDS
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Tags:477867-64-4 Molecular Formula|477867-64-4 MDL|477867-64-4 SMILES|477867-64-4 2-(4-methoxyphenyl)-2-[3-(trifluoromethyl)quinoxalin-2-yl]acetonitrile