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915369-16-3,MFCD28991955
Catalog No.:AA00IGO8

915369-16-3 | Ethyl 2-cyano-3-((2-(dimethylcarbamoyl)-4-nitrophenyl)imino)propanoate

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  • Technical Information
  • Properties
  • Literature
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Technical Information
Catalog Number:
AA00IGO8
Chemical Name:
Ethyl 2-cyano-3-((2-(dimethylcarbamoyl)-4-nitrophenyl)imino)propanoate
CAS Number:
915369-16-3
Molecular Formula:
C15H16N4O5
Molecular Weight:
332.3113
MDL Number:
MFCD28991955
SMILES:
CCOC(=O)C(C=Nc1ccc(cc1C(=O)N(C)C)[N+](=O)[O-])C#N
Properties
Computed Properties
 
Complexity:
560  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.2  

Literature
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SDS
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Tags:915369-16-3 Molecular Formula|915369-16-3 MDL|915369-16-3 SMILES|915369-16-3 Ethyl 2-cyano-3-((2-(dimethylcarbamoyl)-4-nitrophenyl)imino)propanoate
Catalog No.: AA00IGO8
915369-16-3,MFCD28991955
915369-16-3 | Ethyl 2-cyano-3-((2-(dimethylcarbamoyl)-4-nitrophenyl)imino)propanoate
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA00IGO8
Chemical Name: Ethyl 2-cyano-3-((2-(dimethylcarbamoyl)-4-nitrophenyl)imino)propanoate
CAS Number: 915369-16-3
Molecular Formula: C15H16N4O5
Molecular Weight: 332.3113
MDL Number: MFCD28991955
SMILES: CCOC(=O)C(C=Nc1ccc(cc1C(=O)N(C)C)[N+](=O)[O-])C#N
Properties
Complexity: 560  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 24  
Hydrogen Bond Acceptor Count: 7  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.2  
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