Basic information
- CAS
66941-26-2- Standard SMILES
CCCC1(C(C)OCC)C(=O)NC(=O)NC1=O- InChIKey
LDPXBDDVGWWRTJ-UHFFFAOYSA-N- Molecular formula
- C11H18N2O4
- Average molar mass
- 242.27 g/mol
- Monoisotopic mass
- 242.12665706
Names & identifiers
- Preferred name
- Barbituric acid, 5-(1-ethoxyethyl)-5-propyl-
- IUPAC
- 5-(1-ethoxyethyl)-5-propyl-1,3-diazinane-2,4,6-trione
Names & synonyms
66941-26-2BARBITURIC ACID, 5-(1-ETHOXYETHYL)-5-PROPYL-RefChem:10775385-(1-Ethoxyethyl)-5-propylbarbituric acidBRN 02403944-25-00-00441 (Beilstein Handbook Reference)DTXSID709856585-(1-Ethoxyethyl)-4,6-dihydroxy-5-propylpyrimidin-2(5H)-one
Database identifiers
- CAS
66941-26-2- PubChem CID
- 48481
- DTXSID
DTXSID70985658- Nikkaji
- J105.510K
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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