Home Nitriles 4-hydroxy-6,8-dimethoxyquinoline-3-carbonitrile

4-hydroxy-6,8-dimethoxyquinoline-3-carbonitrile

CAS No.:
61338-39-4
Catalog Number:
AG01AF7X
Molecular Formula:
C12H10N2O3
Molecular Weight:
230.2194
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Product Description
Catalog Number:
AG01AF7X
Chemical Name:
4-hydroxy-6,8-dimethoxyquinoline-3-carbonitrile
CAS Number:
61338-39-4
Molecular Formula:
C12H10N2O3
Molecular Weight:
230.2194
MDL Number:
MFCD13181152
IUPAC Name:
6,8-dimethoxy-4-oxo-1H-quinoline-3-carbonitrile
InChI:
InChI=1S/C12H10N2O3/c1-16-8-3-9-11(10(4-8)17-2)14-6-7(5-13)12(9)15/h3-4,6H,1-2H3,(H,14,15)
InChI Key:
OBTACCPRZUTOOC-UHFFFAOYSA-N
SMILES:
COc1cc(OC)c2c(c1)c(O)c(cn2)C#N
Properties
Complexity:
396  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.069g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.223g/mol
Monoisotopic Mass:
230.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties