Basic information
- CAS
66968-33-0- Standard SMILES
CCC(=CCC1(CC)C(=O)NC(=O)NC1=O)CC- InChIKey
SARLQHKTURSOGN-UHFFFAOYSA-N- Molecular formula
- C13H20N2O3
- Average molar mass
- 252.31 g/mol
- Monoisotopic mass
- 252.1473925
Names & identifiers
- Preferred name
- Barbituric acid, 5-ethyl-5-(3-ethyl-2-pentenyl)-
- IUPAC
- 5-ethyl-5-(3-ethylpent-2-enyl)-1,3-diazinane-2,4,6-trione
- English name
- 5-Ethyl-5-(3-ethyl-2-pentenyl)barbituric acid
- Molecular weight
- 0
Names & synonyms
BARBITURIC ACID, 5-ETHYL-5-(3-ETHYL-2-PENTENYL)-66968-33-0BRN 02215925-Ethyl-5-(3-ethyl-2-pentenyl)barbituric acidAcide 5-(gamma,gamma-diethylallyl) 5-ethyl barbiturique [French]Acide 5-(gamma,gamma-diethylallyl) 5-ethyl barbituriqueDTXSID602171725-ethyl-5-(3-ethylpent-2-en-1-yl)-1,3-diazinane-2,4,6-trione5-Ethyl-5-(3-ethyl-2-pentenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Database identifiers
- CAS
66968-33-0- PubChem CID
- 48732
- DTXSID
DTXSID60217172- Nikkaji
- J105.523B
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 373
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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