Basic information
- CAS
66968-63-6- Standard SMILES
CCN1C(=O)NC(=O)C(C)(C(C)C)C1=O- InChIKey
CRFAQGQUDWDKCO-UHFFFAOYSA-N- Molecular formula
- C10H16N2O3
- Average molar mass
- 212.25 g/mol
- Monoisotopic mass
- 212.11609238
Names & identifiers
- Preferred name
- 3-Ethyl-6-hydroxy-5-methyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione
- IUPAC
- 1-ethyl-5-methyl-5-propan-2-yl-1,3-diazinane-2,4,6-trione
- English name
- 1-Ethyl-5-(1-methylethyl)-5-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione
- Molecular formula
- C10H16N2O3
- Molecular weight
- 212.25
Names & synonyms
66968-63-6DTXSID409857613-Ethyl-6-hydroxy-5-methyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dioneRefChem:1067806DTXCID9014129521-Ethyl-5-isopropyl-5-methylbarbituric acidBRN 0201785BARBITURIC ACID, 1-ETHYL-5-ISOPROPYL-5-METHYL-4-24-00-01901 (Beilstein Handbook Reference)1-Ethyl-5-(1-methylethyl)-5-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-ethyl-5-methyl-5-(1-methylethyl)-
Database identifiers
- CAS
66968-63-6- PubChem CID
- 48775
- DTXSID
DTXSID40985761- Nikkaji
- J105.567D
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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