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68231-98-1 | 5H-[1,3]Oxazolo[3,2-a]quinoline-2,5(1H)-dione
CAS No: 68231-98-1 Catalog No: AG006D2R MDL No:
Product Description
Catalog Number:
AG006D2R
Chemical Name:
5H-[1,3]Oxazolo[3,2-a]quinoline-2,5(1H)-dione
CAS Number:
68231-98-1
Molecular Formula:
C11H7NO3
Molecular Weight:
201.1782
IUPAC Name:
1H-[1,3]oxazolo[3,2-a]quinoline-2,5-dione
InChI:
InChI=1S/C11H7NO3/c13-9-5-10-12(6-11(14)15-10)8-4-2-1-3-7(8)9/h1-5H,6H2
InChI Key:
PWSWKWNDGWYMNL-UHFFFAOYSA-N
SMILES:
O=C1Cn2c(O1)cc(=O)c1c2cccc1
NSC Number:
353091
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.043g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.181g/mol
Monoisotopic Mass:
201.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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