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18337-63-8 | 4(3H)-Pyrimidinone, 6-hydroxy-5-methyl-
CAS No: 18337-63-8 Catalog No: AG0027IT MDL No:
Product Description
Catalog Number:
AG0027IT
Chemical Name:
4(3H)-Pyrimidinone, 6-hydroxy-5-methyl-
CAS Number:
18337-63-8
Molecular Formula:
C5H6N2O2
Molecular Weight:
126.1133
IUPAC Name:
4-hydroxy-5-methyl-1H-pyrimidin-6-one
InChI:
InChI=1S/C5H6N2O2/c1-3-4(8)6-2-7-5(3)9/h2H,1H3,(H2,6,7,8,9)
InChI Key:
OREVOAMPEBWISR-UHFFFAOYSA-N
SMILES:
Oc1nc[nH]c(=O)c1C
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.043g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
126.115g/mol
Monoisotopic Mass:
126.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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