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Home Nitro Compounds 42106-50-3
42106-50-3,MFCD01788140
Catalog No.:AA00CK1Y

42106-50-3 | 5-Nitro-2-(piperidin-1-yl)benzoic acid

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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA00CK1Y
Chemical Name:
5-Nitro-2-(piperidin-1-yl)benzoic acid
CAS Number:
42106-50-3
Molecular Formula:
C12H14N2O4
Molecular Weight:
250.2506
MDL Number:
MFCD01788140
SMILES:
OC(=O)c1cc(ccc1N1CCCCC1)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
323  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.4  

Literature

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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Tags:42106-50-3 Molecular Formula|42106-50-3 MDL|42106-50-3 SMILES|42106-50-3 5-Nitro-2-(piperidin-1-yl)benzoic acid