Home Nitros 7,8-difluoro-3-nitroquinolin-4-ol

7,8-difluoro-3-nitroquinolin-4-ol

CAS No.:
1955498-39-1
Catalog Number:
AG01C42W
Molecular Formula:
C9H4F2N2O3
Molecular Weight:
226.1365
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Product Description
Catalog Number:
AG01C42W
Chemical Name:
7,8-difluoro-3-nitroquinolin-4-ol
CAS Number:
1955498-39-1
Molecular Formula:
C9H4F2N2O3
Molecular Weight:
226.1365
MDL Number:
MFCD27974898
IUPAC Name:
7,8-difluoro-3-nitro-1H-quinolin-4-one
InChI:
InChI=1S/C9H4F2N2O3/c10-5-2-1-4-8(7(5)11)12-3-6(9(4)14)13(15)16/h1-3H,(H,12,14)
InChI Key:
JZIVWOYVHCMPQN-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc2c(c1O)ccc(c2F)F
Properties
Complexity:
366  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.019g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.139g/mol
Monoisotopic Mass:
226.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties