Basic information
- CAS
65717-13-7- Standard SMILES
O=C([O-])c1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-].[K+]- InChIKey
VLUWZLLGDFXCTJ-UHFFFAOYSA-M- Molecular formula
- C5H2KN3O6
- Average molar mass
- 239.18 g/mol
- Monoisotopic mass
- 238.95806628
Names & identifiers
- Preferred name
- 4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-5-nitro-2,6-dioxo-, potassium salt (1:1)
- IUPAC
- potassium 5-nitro-2,4-dioxo-1H-pyrimidine-6-carboxylate
Names & synonyms
65717-13-74-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-5-nitro-2,6-dioxo-, monopotassium saltEINECS 265-891-2DTXSID7070343NSC 3382174-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-5-nitro-2,6-dioxo-, potassium salt (1:1)RefChem:100459DTXCID1044647Nitroorotic acid, potassium saltPotassium 5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylatepotassium;5-nitro-2,4-dioxo-1H-pyrimidine-6-carboxylateNSC-338217
Show more names
Potassium 5-nitroorotateSCHEMBL1460665D9CU794GXSCHEMBL4718610AKOS002304201AKOS003386913AKOS015955449NS00088326
Database identifiers
- CAS
65717-13-7- PubChem CID
- 5484599
- DTXSID
DTXSID7070343- UNII
- 5D9CU794GX
- EC Number
- 265-891-2
Properties
Computed structural properties
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 372
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS ClassificationNot Classified
Hazard information
Hazard Classes and CategoriesNot Classified
Chemistry & industry
Uses & manufacturing
General Manufacturing Information4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-5-nitro-2,6-dioxo-, potassium salt (1:1): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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