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18014-44-3 | 2(1H)-Pyrimidinone, 5-fluoro-6-(hydroxyamino)-
CAS No: 18014-44-3 Catalog No: AG0021Q4 MDL No:
Product Description
Catalog Number:
AG0021Q4
Chemical Name:
2(1H)-Pyrimidinone, 5-fluoro-6-(hydroxyamino)-
CAS Number:
18014-44-3
Molecular Formula:
C4H4FN3O2
Molecular Weight:
145.0919
IUPAC Name:
5-fluoro-6-(hydroxyamino)-1H-pyrimidin-2-one
InChI:
InChI=1S/C4H4FN3O2/c5-2-1-6-4(9)7-3(2)8-10/h1,10H,(H2,6,7,8,9)
InChI Key:
AGMXBUQUJJTPLT-UHFFFAOYSA-N
SMILES:
ONc1c(F)cnc(=O)[nH]1
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.029g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
145.093g/mol
Monoisotopic Mass:
145.029g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
73.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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