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120051-18-5 | 5,6-Quinolinedione, 8-methoxy-2-methyl-
CAS No: 120051-18-5 Catalog No: AG000Q7I MDL No:
Product Description
Catalog Number:
AG000Q7I
Chemical Name:
5,6-Quinolinedione, 8-methoxy-2-methyl-
CAS Number:
120051-18-5
Molecular Formula:
C11H9NO3
Molecular Weight:
203.1941
IUPAC Name:
8-methoxy-2-methylquinoline-5,6-dione
InChI:
InChI=1S/C11H9NO3/c1-6-3-4-7-10(12-6)9(15-2)5-8(13)11(7)14/h3-5H,1-2H3
InChI Key:
MIRKLMFVYJGYPH-UHFFFAOYSA-N
SMILES:
COC1=CC(=O)C(=O)c2c1nc(C)cc2
NSC Number:
628365
Properties
Complexity:
335
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:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.197g/mol
Monoisotopic Mass:
203.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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