Sodium aprobarbital
Basic information
- CAS
125-88-2- Standard SMILES
C=CCC1(C(C)C)C(=O)NC(=O)NC1=O.[Na+]- InChIKey
HLFOAHHCDKJHCJ-UHFFFAOYSA-N- Molecular formula
- C10H14N2NaO3+
- Average molar mass
- 233.22 g/mol
- Monoisotopic mass
- 233.09021159
Names & identifiers
- Preferred name
- Sodium aprobarbital
- IUPAC
- sodium 5-propan-2-yl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
- English name
- sodium 5-allyl-5-isopropylbarbiturate
- Molecular formula
- C10H12N2Na2O3
- Molecular weight
- 254.19342
Names & synonyms
AlubarbAprotalArbatalBaritalAlurate sodiumSodium aprobarbital5-Allyl-5-isopropylbarbituric acid sodium saltBarbituric acid, sodium derivHLFOAHHCDKJHCJ-UHFFFAOYSA-Nsodium;5-propan-2-yl-5-prop-2-enyl-1,3-diazinane-2,4,6-trioneNSC120767WLN: T6MV DVN CHJ CY C2U1 FO &-NA-
Show more names
SomnipronSodium aprobarAllirate sodiumButalbital sodiumAprobarbital sodiumsodium 5-allyl-5-isopropylbarbiturate
2,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-methylethyl)-5-(2-propenyl)-, monosodium salt
Database identifiers
- CAS
125-88-2- PubChem CID
- 23616248
Properties
Computed structural properties
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 1
- Complexity
- 314
Physicochemical properties
- FDA UNII
- 6 T90V76R18 · 6T90V76R18
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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