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14435-54-2 | 2(1H)-Pyrimidinone, 4-amino-5,6-dihydro-5-methyl-
CAS No: 14435-54-2 Catalog No: AG001JEQ MDL No:
Product Description
Catalog Number:
AG001JEQ
Chemical Name:
2(1H)-Pyrimidinone, 4-amino-5,6-dihydro-5-methyl-
CAS Number:
14435-54-2
Molecular Formula:
C5H9N3O
Molecular Weight:
127.1445
IUPAC Name:
4-amino-5-methyl-5,6-dihydro-1H-pyrimidin-2-one
InChI:
InChI=1S/C5H9N3O/c1-3-2-7-5(9)8-4(3)6/h3H,2H2,1H3,(H3,6,7,8,9)
InChI Key:
BOYQFUWAOKMHLW-UHFFFAOYSA-N
SMILES:
CC1CNC(=O)N=C1N
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.075g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
127.147g/mol
Monoisotopic Mass:
127.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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