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88214-12-4 | [2,2'-Bipyridin]-6(1H)-one, 1,5,5'-trimethyl-
CAS No: 88214-12-4 Catalog No: AG004BXY MDL No:
Product Description
Catalog Number:
AG004BXY
Chemical Name:
[2,2'-Bipyridin]-6(1H)-one, 1,5,5'-trimethyl-
CAS Number:
88214-12-4
Molecular Formula:
C13H14N2O
Molecular Weight:
214.2631
IUPAC Name:
1,3-dimethyl-6-(5-methylpyridin-2-yl)pyridin-2-one
InChI:
InChI=1S/C13H14N2O/c1-9-4-6-11(14-8-9)12-7-5-10(2)13(16)15(12)3/h4-8H,1-3H3
InChI Key:
YNKNWSKKXMPWHC-UHFFFAOYSA-N
SMILES:
Cc1ccc(nc1)c1ccc(c(=O)n1C)C
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.111g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.268g/mol
Monoisotopic Mass:
214.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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