33489-49-5,MFCD01014749
Catalog No.:AA01EVDB

33489-49-5 | 2-(Hydroxyimino)-1,2-dihydroacenaphthylen-1-one

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  • Technical Information
  • Properties
  • Literature
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  • Download SDS
Technical Information
Catalog Number:
AA01EVDB
Chemical Name:
2-(Hydroxyimino)-1,2-dihydroacenaphthylen-1-one
CAS Number:
33489-49-5
Molecular Formula:
C12H7NO2
Molecular Weight:
197.1895
MDL Number:
MFCD01014749
SMILES:
O/N=C\1/c2cccc3c2c(C1=O)ccc3
Properties
Computed Properties
 
Complexity:
324  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
1  
Formal Charge:
0  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.8  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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Tags:33489-49-5 Molecular Formula|33489-49-5 MDL|33489-49-5 SMILES|33489-49-5 2-(Hydroxyimino)-1,2-dihydroacenaphthylen-1-one
Catalog No.: AA01EVDB
33489-49-5,MFCD01014749
33489-49-5 | 2-(Hydroxyimino)-1,2-dihydroacenaphthylen-1-one
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: AA01EVDB
Chemical Name: 2-(Hydroxyimino)-1,2-dihydroacenaphthylen-1-one
CAS Number: 33489-49-5
Molecular Formula: C12H7NO2
Molecular Weight: 197.1895
MDL Number: MFCD01014749
SMILES: O/N=C\1/c2cccc3c2c(C1=O)ccc3
Properties
Complexity: 324  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 1  
Formal Charge: 0  
Heavy Atom Count: 15  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.8  
Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

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