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617707-05-8

617707-05-8 | 3-Acetylquinoline-2,4(1H,3H)-dione

CAS No: 617707-05-8 Catalog No: AG01EDTT MDL No:

Product Description

Catalog Number:
AG01EDTT
Chemical Name:
3-Acetylquinoline-2,4(1H,3H)-dione
CAS Number:
617707-05-8
IUPAC Name:
3-acetyl-1H-quinoline-2,4-dione
InChI:
InChI=1S/C11H9NO3/c1-6(13)9-10(14)7-4-2-3-5-8(7)12-11(9)15/h2-5,9H,1H3,(H,12,15)
InChI Key:
RAQZAKPMLUMLML-UHFFFAOYSA-N

Properties

Complexity:
324  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.058g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.197g/mol
Monoisotopic Mass:
203.058g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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