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642477-81-4,MFCD18803254
Catalog No.:AA00IB9H

642477-81-4 | 4-Oxo-1,4-dihydro-quinoline-6-carbonitrile

This product is typically in stock,please click "Inquire" below or
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA00IB9H
Chemical Name:
4-Oxo-1,4-dihydro-quinoline-6-carbonitrile
CAS Number:
642477-81-4
Molecular Formula:
C10H6N2O
Molecular Weight:
170.1674
MDL Number:
MFCD18803254
SMILES:
C1=CC2=C(C=C1C#N)C(=O)C=CN2
Properties
Computed Properties
 
Complexity:
299  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
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:
0.3  

Literature
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SDS
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Tags:642477-81-4 Molecular Formula|642477-81-4 MDL|642477-81-4 SMILES|642477-81-4 4-Oxo-1,4-dihydro-quinoline-6-carbonitrile
Catalog No.: AA00IB9H
642477-81-4,MFCD18803254
642477-81-4 | 4-Oxo-1,4-dihydro-quinoline-6-carbonitrile
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: AA00IB9H
Chemical Name: 4-Oxo-1,4-dihydro-quinoline-6-carbonitrile
CAS Number: 642477-81-4
Molecular Formula: C10H6N2O
Molecular Weight: 170.1674
MDL Number: MFCD18803254
SMILES: C1=CC2=C(C=C1C#N)C(=O)C=CN2
Properties
Complexity: 299  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
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: 0.3  
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