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Home Amines 400751-63-5
400751-63-5,MFCD03001303
Catalog No.:AA00CASE

400751-63-5 | 3-Amino-4-{[3-(trifluoromethyl)phenyl]sulfanyl} benzenecarbonitrile

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100mg
in stock  
$258.00   $180.00
- +
1g
in stock  
$619.00   $433.00
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Technical Information
Catalog Number:
AA00CASE
Chemical Name:
3-Amino-4-{[3-(trifluoromethyl)phenyl]sulfanyl} benzenecarbonitrile
CAS Number:
400751-63-5
Molecular Formula:
C14H9F3N2S
Molecular Weight:
294.2949
MDL Number:
MFCD03001303
SMILES:
N#Cc1ccc(c(c1)N)Sc1cccc(c1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
376  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
3.9  

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Tags:400751-63-5 Molecular Formula|400751-63-5 MDL|400751-63-5 SMILES|400751-63-5 3-Amino-4-{[3-(trifluoromethyl)phenyl]sulfanyl} benzenecarbonitrile