Basic information
- CAS
98792-81-5- Standard SMILES
CC(=O)c1c(O)nc[nH]c1=O- InChIKey
PYJZBCIQPVBBPY-UHFFFAOYSA-N- Molecular formula
- C6H6N2O3
- Average molar mass
- 154.12 g/mol
- Monoisotopic mass
- 154.03784206
Names & identifiers
- Preferred name
- 6-Hydroxy-5-acetyl-4-oxo-1,6-dihydropyrimidine
- IUPAC
- 5-acetyl-4-hydroxy-1H-pyrimidin-6-one
- English name
- 5-Acetyl-6-hydroxy-4(1H)-pyrimidinone
- Molecular formula
- C6H6N2O3
- Molecular weight
- 0
Names & synonyms
6-Hydroxy-5-acetyl-4-oxo-1,6-dihydropyrimidine98792-81-55-ACETYL-3,4-DIHYDRO-6-HYDROXYPYRIMIDIN-4-ONE4,6-dihydroxy-5-acetylpyrimidinePYJZBCIQPVBBPY-UHFFFAOYSA-NDTXSID2013460575-Acetyl-6-hydroxy-4(3H)-pyrimidinone5-Acetyl-6-hydroxy-4(3H)-pyrimidinone #Pyrimidine, 6-oxo-5-acetyl-4-hydroxy-1,6-dihydro-Q633988365-Acetyl-6-hydroxy-4(1H)-pyrimidinone
Database identifiers
- CAS
98792-81-5- PubChem CID
- 587455
- DTXSID
DTXSID201346057- Nikkaji
- J46.650F
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 78.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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