Home Other Building Blocks 1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one

1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one

CAS No.:
99069-52-0
Catalog Number:
AG01AA5G
Molecular Formula:
C10H12N4O
Molecular Weight:
204.2285
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Product Description
Catalog Number:
AG01AA5G
Chemical Name:
1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one
CAS Number:
99069-52-0
Molecular Formula:
C10H12N4O
Molecular Weight:
204.2285
MDL Number:
MFCD00458590
IUPAC Name:
2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-4H-pyrazol-3-one
InChI:
InChI=1S/C10H12N4O/c1-6-4-7(2)12-10(11-6)14-9(15)5-8(3)13-14/h4H,5H2,1-3H3
InChI Key:
OAPBOQRKEINXTQ-UHFFFAOYSA-N
SMILES:
CC1=NN(C(=O)C1)c1nc(C)cc(n1)C
Properties
Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.101g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.233g/mol
Monoisotopic Mass:
204.101g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties