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78195-30-9 | 5,6-dimethyl-2-methylamino-1H-pyrimidin-4-one
CAS No: 78195-30-9 Catalog No: AG0054PC MDL No:
Product Description
Catalog Number:
AG0054PC
Chemical Name:
5,6-dimethyl-2-methylamino-1H-pyrimidin-4-one
CAS Number:
78195-30-9
Molecular Formula:
C7H11N3O
Molecular Weight:
153.1817
IUPAC Name:
4,5-dimethyl-2-(methylamino)-1H-pyrimidin-6-one
InChI:
InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)
InChI Key:
IFOLNWVBRSCJOJ-UHFFFAOYSA-N
SMILES:
CNc1nc(=O)c(c([nH]1)C)C
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.09g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
153.185g/mol
Monoisotopic Mass:
153.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
Literature
| Title | Journal |
|---|---|
| Biological monitoring for exposure to pirimicarb: method development and a human oral dosing study. | Toxicology letters 20100115 |
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