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15450-73-4 | 1H-quinoline-2,5,8-trione
CAS No: 15450-73-4 Catalog No: AG00B30N MDL No:
Product Description
Catalog Number:
AG00B30N
Chemical Name:
1H-quinoline-2,5,8-trione
CAS Number:
15450-73-4
IUPAC Name:
1H-quinoline-2,5,8-trione
InChI:
InChI=1S/C9H5NO3/c11-6-2-3-7(12)9-5(6)1-4-8(13)10-9/h1-4H,(H,10,13)
InChI Key:
JXTKZMFPFKZRHP-UHFFFAOYSA-N
NSC Number:
107098
Properties
Complexity:
413
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.027g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.143g/mol
Monoisotopic Mass:
175.027g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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