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115170-26-8 | 5,8-Quinolinedione, 4-methoxy-
CAS No: 115170-26-8 Catalog No: AG000GDQ MDL No:MFCD27941786
Product Description
Catalog Number:
AG000GDQ
Chemical Name:
5,8-Quinolinedione, 4-methoxy-
CAS Number:
115170-26-8
Molecular Formula:
C10H7NO3
Molecular Weight:
189.1675
MDL Number:
MFCD27941786
IUPAC Name:
4-methoxyquinoline-5,8-dione
InChI:
InChI=1S/C10H7NO3/c1-14-8-4-5-11-10-7(13)3-2-6(12)9(8)10/h2-5H,1H3
InChI Key:
QMNMSCIVSKTGMA-UHFFFAOYSA-N
SMILES:
COc1ccnc2c1C(=O)C=CC2=O
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.043g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.17g/mol
Monoisotopic Mass:
189.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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