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1598-63-6

1598-63-6 | 4(3H)-Pyrimidinone, 5-fluoro-6-hydroxy-2-methyl-

CAS No: 1598-63-6 Catalog No: AG001REG MDL No:MFCD11520459

Product Description

Catalog Number:
AG001REG
Chemical Name:
4(3H)-Pyrimidinone, 5-fluoro-6-hydroxy-2-methyl-
CAS Number:
1598-63-6
Molecular Formula:
C5H5FN2O2
Molecular Weight:
144.1038
MDL Number:
MFCD11520459
IUPAC Name:
5-fluoro-4-hydroxy-2-methyl-1H-pyrimidin-6-one
InChI:
InChI=1S/C5H5FN2O2/c1-2-7-4(9)3(6)5(10)8-2/h1H3,(H2,7,8,9,10)
InChI Key:
REAPDCOFEGTTLS-UHFFFAOYSA-N
SMILES:
Oc1nc(C)[nH]c(=O)c1F
NSC Number:
33038

Properties

Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.034g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
144.105g/mol
Monoisotopic Mass:
144.034g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  

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