Barbituric acid, 5-ethyl-5-(methoxymethyl)-
Basic information
- CAS
66968-68-1- Standard SMILES
CCC1(COC)C(=O)NC(=O)NC1=O- InChIKey
POJHSILFNQHBRV-UHFFFAOYSA-N- Molecular formula
- C8H12N2O4
- Average molar mass
- 200.19 g/mol
- Monoisotopic mass
- 200.07970687
Names & identifiers
- Preferred name
- Barbituric acid, 5-ethyl-5-(methoxymethyl)-
- IUPAC
- 5-ethyl-5-(methoxymethyl)-1,3-diazinane-2,4,6-trione
- English name
- 5-Ethyl-5-(methoxymethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
- Molecular formula
- C8H12N2O4
- Molecular weight
- 200.19
Names & synonyms
66968-68-1BARBITURIC ACID, 5-ETHYL-5-(METHOXYMETHYL)-RefChem:10776855-Ethyl-5-(methoxymethyl)barbituric acidBRN 0195091NSC85258NCIOpen2_0012105-25-03-00280 (Beilstein Handbook Reference)DTXSID80985765NSC 85258NSC-852582,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(methoxymethyl)-
Show more names
5-Ethyl-5-(methoxymethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(methoxymethyl)-
5-Ethyl-4,6-dihydroxy-5-(methoxymethyl)pyrimidin-2(5H)-one
Database identifiers
- CAS
66968-68-1- PubChem CID
- 48782
- DTXSID
DTXSID80985765- Nikkaji
- J105.574G
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 84.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 267
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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