Basic information
- CAS
66968-83-0- Standard SMILES
CCCC(C)CCCC1(CC)C(=O)[N-]C(=O)NC1=O.[Na+]- InChIKey
DYSODNWVECDIPH-UHFFFAOYSA-M- Molecular formula
- C14H23N2NaO3
- Average molar mass
- 290.33 g/mol
- Monoisotopic mass
- 290.16063688
Names & identifiers
- Preferred name
- Barbituric acid, 5-ethyl-5-(4-methylheptyl)-, sodium salt
- IUPAC
- sodium 5-ethyl-5-(4-methylheptyl)pyrimidin-3-ide-2,4,6-trione
Names & synonyms
BARBITURIC ACID, 5-ETHYL-5-(4-METHYLHEPTYL)-, SODIUM SALT66968-83-0RefChem:1077681Sodium 5-ethyl-5-(4-methylheptyl)barbiturate5-Ethyl-5-(4-methylheptyl)barbituric acid sodium salt
Database identifiers
- CAS
66968-83-0- PubChem CID
- 23716014
Properties
Computed structural properties
- Topological polar surface area
- 64.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 373
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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