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2080-17-3 | 4(1H)-Pyrimidinone, 2-amino-1-methyl-
CAS No: 2080-17-3 Catalog No: AG002JFS MDL No:
Product Description
Catalog Number:
AG002JFS
Chemical Name:
4(1H)-Pyrimidinone, 2-amino-1-methyl-
CAS Number:
2080-17-3
Molecular Formula:
C5H7N3O
Molecular Weight:
125.1286
IUPAC Name:
2-amino-1-methylpyrimidin-4-one
InChI:
InChI=1S/C5H7N3O/c1-8-3-2-4(9)7-5(8)6/h2-3H,1H3,(H2,6,7,9)
InChI Key:
NINMLCLBRADCOF-UHFFFAOYSA-N
SMILES:
Cn1ccc(=O)nc1N
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.059g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
125.131g/mol
Monoisotopic Mass:
125.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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