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477851-21-1,MFCD00138248
Catalog No.:AA00ITV9

477851-21-1 | (2E)-3-[(4-chlorophenyl)amino]-2-(thiophen-3-yl)prop-2-enenitrile

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Technical Information
Catalog Number:
AA00ITV9
Chemical Name:
(2E)-3-[(4-chlorophenyl)amino]-2-(thiophen-3-yl)prop-2-enenitrile
CAS Number:
477851-21-1
Molecular Formula:
C13H9ClN2S
Molecular Weight:
260.7420
MDL Number:
MFCD00138248
SMILES:
N#C/C(=C/Nc1ccc(cc1)Cl)/c1cscc1
Properties
Computed Properties
 
Complexity:
326  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
4.3  

Literature
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SDS
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Tags:477851-21-1 Molecular Formula|477851-21-1 MDL|477851-21-1 SMILES|477851-21-1 (2E)-3-[(4-chlorophenyl)amino]-2-(thiophen-3-yl)prop-2-enenitrile