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89733-49-3 | [3,4'-Bipyridin]-6(1H)-one, 4,5-dihydro-2,4-dimethyl-
CAS No: 89733-49-3 Catalog No: AG0041PR MDL No:
Product Description
Catalog Number:
AG0041PR
Chemical Name:
[3,4'-Bipyridin]-6(1H)-one, 4,5-dihydro-2,4-dimethyl-
CAS Number:
89733-49-3
Molecular Formula:
C12H14N2O
Molecular Weight:
202.2524
IUPAC Name:
4,6-dimethyl-5-pyridin-4-yl-3,4-dihydro-1H-pyridin-2-one
InChI:
InChI=1S/C12H14N2O/c1-8-7-11(15)14-9(2)12(8)10-3-5-13-6-4-10/h3-6,8H,7H2,1-2H3,(H,14,15)
InChI Key:
QYNYDSGSCUAAEI-UHFFFAOYSA-N
SMILES:
O=C1CC(C)C(=C(N1)C)c1ccncc1
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.257g/mol
Monoisotopic Mass:
202.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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