Home Amines 338402-04-3
338402-04-3,MFCD01316649
Catalog No.:AA00IO9D

338402-04-3 | (2E)-1-(2,5-dichlorothiophen-3-yl)-3-[(3-nitrophenyl)amino]prop-2-en-1-one

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Technical Information
Catalog Number:
AA00IO9D
Chemical Name:
(2E)-1-(2,5-dichlorothiophen-3-yl)-3-[(3-nitrophenyl)amino]prop-2-en-1-one
CAS Number:
338402-04-3
Molecular Formula:
C13H8Cl2N2O3S
Molecular Weight:
343.1852
MDL Number:
MFCD01316649
SMILES:
Clc1sc(c(c1)C(=O)/C=C/Nc1cccc(c1)[N+](=O)[O-])Cl
Properties
Computed Properties
 
Complexity:
430  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
5.4  

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SDS
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Tags:338402-04-3 Molecular Formula|338402-04-3 MDL|338402-04-3 SMILES|338402-04-3 (2E)-1-(2,5-dichlorothiophen-3-yl)-3-[(3-nitrophenyl)amino]prop-2-en-1-one