Basic information
- CAS
67114-19-6- Standard SMILES
CCC1(CCCc2ccccc2)C(=O)[N-]C(=O)NC1=O.[Na+]- InChIKey
OPAHETGXPTVRBL-UHFFFAOYSA-M- Molecular formula
- C15H17N2NaO3
- Average molar mass
- 296.3 g/mol
- Monoisotopic mass
- 296.11368669
Names & identifiers
- Preferred name
- Sodium 5-ethyl-6-hydroxy-2-oxo-5-(3-phenylpropyl)-2,5-dihydropyrimidin-4-olate
- IUPAC
- sodium 5-ethyl-5-(3-phenylpropyl)pyrimidin-3-ide-2,4,6-trione
Names & synonyms
67114-19-6DTXSID50986143Sodium 5-ethyl-6-hydroxy-2-oxo-5-(3-phenylpropyl)-2,5-dihydropyrimidin-4-olateRefChem:1098727DTXCID7014133305-Ethyl-5-(3-phenylpropyl)barbituric acid sodium saltBARBITURIC ACID, 5-ETHYL-5-(3-PHENYLPROPYL)-, SODIUM SALT
Database identifiers
- CAS
67114-19-6- PubChem CID
- 23716072
Properties
Computed structural properties
- Topological polar surface area
- 64.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 408
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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