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Home > Pyridines > 204394-52-5
204394-52-5 | 4(3H)-Pyrimidinone, 5,6-dimethyl-2-(2-pyridinyl)-
CAS No: 204394-52-5 Catalog No: AG0029GI MDL No:MFCD00269287
Product Description
Catalog Number:
AG0029GI
Chemical Name:
4(3H)-Pyrimidinone, 5,6-dimethyl-2-(2-pyridinyl)-
CAS Number:
204394-52-5
Molecular Formula:
C11H11N3O
Molecular Weight:
201.2245
MDL Number:
MFCD00269287
IUPAC Name:
4,5-dimethyl-2-pyridin-2-yl-1H-pyrimidin-6-one
InChI:
InChI=1S/C11H11N3O/c1-7-8(2)13-10(14-11(7)15)9-5-3-4-6-12-9/h3-6H,1-2H3,(H,13,14,15)
InChI Key:
RVSHHTOLEDONMB-UHFFFAOYSA-N
SMILES:
Cc1nc([nH]c(=O)c1C)c1ccccn1
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.229g/mol
Monoisotopic Mass:
201.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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