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N(4)-Hydroxy-5-fluorocytosine

HCID 167689
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Basic information

CAS
18014-44-3
Standard SMILES
O=c1ncc(F)c(NO)[nH]1
InChIKey
AGMXBUQUJJTPLT-UHFFFAOYSA-N
Molecular formula
C4H4FN3O2
Average molar mass
145.09 g/mol
Monoisotopic mass
145.02875454

Names & identifiers

Preferred name
N(4)-Hydroxy-5-fluorocytosine
IUPAC
5-fluoro-6-(hydroxyamino)-1H-pyrimidin-2-one
English name
2,4(1H,3H)-Pyrimidinedione, 5-fluoro-, 4-oxime (9CI)
Molecular formula
C4H4FN3O2
Molecular weight
145.09

Names & synonyms

18014-44-3N(4)-Hydroxy-5-fluorocytosineN(4)-OH-5-FCN(4)-OH-5-Fluoro-CDTXSID10170920RefChem:160699DTXCID60934115-Fluoro-N-hydroxycytosine5-fluoro-6-(hydroxyamino)pyrimidin-2(1h)-onen4-hydroxy-5-fluorocytosineCytosine, 5-fluoro-N-hydroxy-AKOS006357761
Show more names
2(1H)-Pyrimidinone, 5-fluoro-6-(hydroxyamino)-2,4(1H,3H)-Pyrimidinedione, 5-fluoro-, 4-oxime (9CI)
2-hydroxy-4-hydroxyamino-5-fluoropyrimidine

Database identifiers

CAS
18014-44-3
PubChem CID
167689
DTXSID
DTXSID10170920

Properties

Computed structural properties

XLogP
-0.7
Topological polar surface area
73.7 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
10
Formal charge
0
Complexity
223

Related reactions

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Compound notes

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