Home Nitros 8-Bromo-6-nitroquinoline

8-Bromo-6-nitroquinoline

CAS No.:
120287-30-1
Catalog Number:
AG0095HI
Molecular Formula:
C9H5BrN2O2
Molecular Weight:
253.0522
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Product Description
Catalog Number:
AG0095HI
Chemical Name:
8-Bromo-6-nitroquinoline
CAS Number:
120287-30-1
Molecular Formula:
C9H5BrN2O2
Molecular Weight:
253.0522
MDL Number:
MFCD26407176
IUPAC Name:
8-bromo-6-nitroquinoline
InChI:
InChI=1S/C9H5BrN2O2/c10-8-5-7(12(13)14)4-6-2-1-3-11-9(6)8/h1-5H
InChI Key:
ROMYKZIUOIXCRR-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(Br)c2c(c1)cccn2
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.953g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.055g/mol
Monoisotopic Mass:
251.953g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties