Home Nitriles 5,7-difluoro-4-hydroxyquinoline-3-carbonitrile

5,7-difluoro-4-hydroxyquinoline-3-carbonitrile

CAS No.:
541505-11-7
Catalog Number:
AG00DB3U
Molecular Formula:
C10H4F2N2O
Molecular Weight:
206.1484
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Product Description
Catalog Number:
AG00DB3U
Chemical Name:
5,7-difluoro-4-hydroxyquinoline-3-carbonitrile
CAS Number:
541505-11-7
Molecular Formula:
C10H4F2N2O
Molecular Weight:
206.1484
MDL Number:
MFCD13181113
IUPAC Name:
5,7-difluoro-4-oxo-1H-quinoline-3-carbonitrile
InChI:
InChI=1S/C10H4F2N2O/c11-6-1-7(12)9-8(2-6)14-4-5(3-13)10(9)15/h1-2,4H,(H,14,15)
InChI Key:
QOFRDVZHEZZMRG-UHFFFAOYSA-N
SMILES:
N#Cc1cnc2c(c1O)c(F)cc(c2)F
Properties
Complexity:
371  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.029g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
206.152g/mol
Monoisotopic Mass:
206.029g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties