57037-95-3,MFCD03950769
Catalog No.:AA00EN88

57037-95-3 | 2-(4-Aminophenyl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione

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  • Technical Information
  • Properties
  • Literature
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Technical Information
Catalog Number:
AA00EN88
Chemical Name:
2-(4-Aminophenyl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
CAS Number:
57037-95-3
Molecular Formula:
C18H11N3O4
Molecular Weight:
333.2976
MDL Number:
MFCD03950769
SMILES:
Nc1ccc(cc1)n1c(=O)c2cccc3c2c(c1=O)ccc3[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
581  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.9  

Literature
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Additional Info:
SDS
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Tags:57037-95-3 Molecular Formula|57037-95-3 MDL|57037-95-3 SMILES|57037-95-3 2-(4-Aminophenyl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog No.: AA00EN88
57037-95-3,MFCD03950769
57037-95-3 | 2-(4-Aminophenyl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
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: AA00EN88
Chemical Name: 2-(4-Aminophenyl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
CAS Number: 57037-95-3
Molecular Formula: C18H11N3O4
Molecular Weight: 333.2976
MDL Number: MFCD03950769
SMILES: Nc1ccc(cc1)n1c(=O)c2cccc3c2c(c1=O)ccc3[N+](=O)[O-]
Properties
Complexity: 581  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 25  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.9  
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