Basic information
- CAS
891-90-7- Standard SMILES
CCC1(C2=CCCCC2)C(=O)N(C)C(=O)N(C)C1=O- InChIKey
BXMWIGPYMDHLKE-UHFFFAOYSA-N- Molecular formula
- C14H20N2O3
- Average molar mass
- 264.32 g/mol
- Monoisotopic mass
- 264.1473925
Names & identifiers
- Preferred name
- Barbituric acid, 5-(1-cyclohexen-1-yl)-5-ethyl-1,3-dimethyl-
- IUPAC
- 5-(cyclohexen-1-yl)-5-ethyl-1,3-dimethyl-1,3-diazinane-2,4,6-trione
- English name
- 5-(1-Cyclohexen-1-yl)-5-ethyl-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
- Molecular weight
- 0
Names & synonyms
Barbituric acid, 5-(1-cyclohexen-1-yl)-5-ethyl-1,3-dimethyl-DTXSID40346939BXMWIGPYMDHLKE-UHFFFAOYSA-NCyclobarbitone di-methyl derivative5-(cyclohex-1-en-1-yl)-5-ethyl-1,3-dimethyl-1,3-diazinane-2,4,6-trione5-(cyclohexen-1-yl)-5-ethyl-1,3-dimethyl-1,3-diazinane-2,4,6-trione891-90-7NS001139465-(1-Cyclohexen-1-yl)-5-ethyl-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione #5-(1-Cyclohexen-1-yl)-5-ethyl-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Database identifiers
- CAS
891-90-7- PubChem CID
- 616596
- DTXSID
DTXSID40346939- Nikkaji
- J105.054K
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 443
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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