5,5-Diethyl-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Basic information
- CAS
714-59-0- Standard SMILES
CCC1(CC)C(=O)N(C)C(=O)N(C)C1=O- InChIKey
RGLAXEITJXZVAN-UHFFFAOYSA-N- Molecular formula
- C10H16N2O3
- Average molar mass
- 212.25 g/mol
- Monoisotopic mass
- 212.11609238
Names & identifiers
- Preferred name
- 5,5-Diethyl-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
- IUPAC
- 5,5-diethyl-1,3-dimethyl-1,3-diazinane-2,4,6-trione
- English name
- 1,3-dimethylbarbital
- Molecular weight
- 0
Names & synonyms
1,3-Dimethylbarbital714-59-01,3-Dimethyl-5,5-diethylbarbituric acid5,5-Diethyl-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrioneDTXSID50221581RefChem:912923DTXCID80144072DimethylveronalDimethylbarbitalN,N'-Dimethylbarbital5,5-diethyl-1,3-dimethyl-1,3-diazinane-2,4,6-trione5,5-Diethyl-1,3-dimethylbarbituric acid
Show more names
1,3-Dimethyl-5,5-diethylpyrimidine-2,4,6(1H,3H,5H)-trione
BARBITURIC ACID, 5,5-DIETHYL-1,3-DIMETHYL-2,4,6(1H,3H,5H)-Pyrimidinetrione, 5,5-diethyl-1,3-dimethyl-BRN 0199727CBMicro_005181Cambridge id 5174658SCHEMBL11730000RGLAXEITJXZVAN-UHFFFAOYSA-NSMSF0004096
Database identifiers
- CAS
714-59-0- PubChem CID
- 12847
- DTXSID
DTXSID50221581- Nikkaji
- J105.164D
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 295
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Related reactions
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Compound notes
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