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88075-50-7 | 4(1H)-Pyrimidinone, 2-amino-5,6-dihydro-1-methyl-
CAS No: 88075-50-7 Catalog No: AG004ET5 MDL No:
Product Description
Catalog Number:
AG004ET5
Chemical Name:
4(1H)-Pyrimidinone, 2-amino-5,6-dihydro-1-methyl-
CAS Number:
88075-50-7
Molecular Formula:
C5H9N3O
Molecular Weight:
127.1445
IUPAC Name:
2-amino-3-methyl-4,5-dihydropyrimidin-6-one
InChI:
InChI=1S/C5H9N3O/c1-8-3-2-4(9)7-5(8)6/h2-3H2,1H3,(H2,6,7,9)
InChI Key:
YUAPKJLVUHDQIL-UHFFFAOYSA-N
SMILES:
CN1CCC(=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:
1
Isotope Atom Count:
0
Molecular Weight:
127.147g/mol
Monoisotopic Mass:
127.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3
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