Basic information
- CAS
67050-95-7- Standard SMILES
CCCOC(C)C1(CC)C(=O)NC(=O)NC1=O- InChIKey
RTSWWHJDXLNCRD-UHFFFAOYSA-N- Molecular formula
- C11H18N2O4
- Average molar mass
- 242.27 g/mol
- Monoisotopic mass
- 242.12665706
Names & identifiers
- Preferred name
- Barbituric acid, 5-ethyl-5-(1-propoxyethyl)-
- IUPAC
- 5-ethyl-5-(1-propoxyethyl)-1,3-diazinane-2,4,6-trione
- English name
- 5-Ethyl-5-(1-propoxyethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
- Molecular formula
- C11H18N2O4
- Molecular weight
- 242.27
Names & synonyms
67050-95-7BARBITURIC ACID, 5-ETHYL-5-(1-PROPOXYETHYL)-RefChem:10776685-Ethyl-5-(1-propoxyethyl)barbituric acidBRN 0240048DTXSID909860665-Ethyl-4,6-dihydroxy-5-(1-propoxyethyl)pyrimidin-2(5H)-one5-Ethyl-5-(1-propoxyethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(1-propoxyethyl)-
Database identifiers
- CAS
67050-95-7- PubChem CID
- 49263
- DTXSID
DTXSID90986066- Nikkaji
- J105.634D
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 84.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 320
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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