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23521-17-7 | 8-Quinolinol, 7-bromo-5-nitro-
CAS No: 23521-17-7 Catalog No: AG002NKA MDL No:
Product Description
Catalog Number:
AG002NKA
Chemical Name:
8-Quinolinol, 7-bromo-5-nitro-
CAS Number:
23521-17-7
Molecular Formula:
C9H5BrN2O3
Molecular Weight:
269.0516
IUPAC Name:
7-bromo-5-nitroquinolin-8-ol
InChI:
InChI=1S/C9H5BrN2O3/c10-6-4-7(12(14)15)5-2-1-3-11-8(5)9(6)13/h1-4,13H
InChI Key:
ZHAQCRBRMYTJHJ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(Br)c(c2c1cccn2)O
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.948g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.054g/mol
Monoisotopic Mass:
267.948g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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