Home Nitro Compounds 391649-88-0
391649-88-0,MFCD00170349
Catalog No.:AA00IX4F

391649-88-0 | 4,4-dimethyl-2-[(2-nitrophenyl)methylidene]-3-oxopentanenitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>90%
1 week  
$299.00   $209.00
- +
5mg
>90%
1 week  
$319.00   $223.00
- +
10mg
>90%
1 week  
$358.00   $250.00
- +
50mg
>90%
1 week  
$446.00   $312.00
- +
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Technical Information
Catalog Number:
AA00IX4F
Chemical Name:
4,4-dimethyl-2-[(2-nitrophenyl)methylidene]-3-oxopentanenitrile
CAS Number:
391649-88-0
Molecular Formula:
C14H14N2O3
Molecular Weight:
258.2726
MDL Number:
MFCD00170349
SMILES:
N#CC(=Cc1ccccc1[N+](=O)[O-])C(=O)C(C)(C)C
Properties
Computed Properties
 
Complexity:
446  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
3  
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.2  

Literature
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SDS
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Tags:391649-88-0 Molecular Formula|391649-88-0 MDL|391649-88-0 SMILES|391649-88-0 4,4-dimethyl-2-[(2-nitrophenyl)methylidene]-3-oxopentanenitrile