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86927-80-2

86927-80-2 | 5,8-Quinolinedione, 6-bromo-7-methoxy-

CAS No: 86927-80-2 Catalog No: AG004L9Y MDL No:

Product Description

Catalog Number:
AG004L9Y
Chemical Name:
5,8-Quinolinedione, 6-bromo-7-methoxy-
CAS Number:
86927-80-2
Molecular Formula:
C10H6BrNO3
Molecular Weight:
268.0635
IUPAC Name:
6-bromo-7-methoxyquinoline-5,8-dione
InChI:
InChI=1S/C10H6BrNO3/c1-15-10-6(11)8(13)5-3-2-4-12-7(5)9(10)14/h2-4H,1H3
InChI Key:
XUFWJDPQHNGZFM-UHFFFAOYSA-N
SMILES:
COC1=C(Br)C(=O)c2c(C1=O)nccc2

Properties

Complexity:
351  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.953g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.066g/mol
Monoisotopic Mass:
266.953g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
56.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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