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723283-90-7 | 5-bromo-3-nitroquinolin-4-ol
CAS No: 723283-90-7 Catalog No: AG01EMJU MDL No:MFCD28041296
Product Description
Catalog Number:
AG01EMJU
Chemical Name:
5-bromo-3-nitroquinolin-4-ol
CAS Number:
723283-90-7
Molecular Formula:
C9H5BrN2O3
Molecular Weight:
269.0516
MDL Number:
MFCD28041296
IUPAC Name:
5-bromo-3-nitro-1H-quinolin-4-one
InChI:
InChI=1S/C9H5BrN2O3/c10-5-2-1-3-6-8(5)9(13)7(4-11-6)12(14)15/h1-4H,(H,11,13)
InChI Key:
NWRGJCHLYXOMGU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc2c(c1O)c(Br)ccc2
Properties
Complexity:
337
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:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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