Basic information
- CAS
67051-18-7- Standard SMILES
C=CC1(CC)C(=O)NC(=O)NC1=O- InChIKey
JGPYBHBUCAHEJK-UHFFFAOYSA-N- Molecular formula
- C8H10N2O3
- Average molar mass
- 182.18 g/mol
- Monoisotopic mass
- 182.06914219
Names & identifiers
- Preferred name
- Barbituric acid, 5-ethyl-5-vinyl-
- IUPAC
- 5-ethenyl-5-ethyl-1,3-diazinane-2,4,6-trione
- English name
- 5-Ethyl-5-vinyl-2,4,6(1H,3H,5H)-pyrimidinetrione
- Molecular formula
- C8H10N2O3
- Molecular weight
- 0
Names & synonyms
5-Ethyl-5-vinylbarbituric acidBARBITURIC ACID, 5-ETHYL-5-VINYL-BRN 016394067051-18-7DTXSID002173534-24-00-01980 (Beilstein Handbook Reference)RefChem:320849DTXCID001398445-ethenyl-5-ethyl-1,3-diazinane-2,4,6-trione5-ethyl-5-vinyl-barbituric acid5-Ethyl-5-vinyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Database identifiers
- CAS
67051-18-7- PubChem CID
- 49289
- DTXSID
DTXSID00217353- Nikkaji
- J105.661A
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 276
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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