Basic information
- CAS
67050-81-1- Standard SMILES
C=CC1(CCCC)C(=O)NC(=O)NC1=O- InChIKey
ZCIJMYRBMAWERK-UHFFFAOYSA-N- Molecular formula
- C10H14N2O3
- Average molar mass
- 210.23 g/mol
- Monoisotopic mass
- 210.10044231
Names & identifiers
- Preferred name
- Barbituric acid, 5-butyl-5-vinyl-
- IUPAC
- 5-butyl-5-ethenyl-1,3-diazinane-2,4,6-trione
- English name
- 5-Butyl-5-vinyl-2,4,6(1H,3H,5H)-pyrimidinetrione
- Molecular formula
- C10H14N2O3
- Molecular weight
- 210.23
Names & synonyms
5-Butyl-5-vinylbarbituric acidBARBITURIC ACID, 5-BUTYL-5-VINYL-BRN 021885067050-81-1DTXSID802173515-24-09-00223 (Beilstein Handbook Reference)RefChem:320797DTXCID801398425-butyl-5-ethenyl-1,3-diazinane-2,4,6-trione5-butyl-5-vinyl-pyrimidine-2,4,6-trione5-Butyl-5-vinyl-2,4,6(1H,3H,5H)-pyrimidinetrione2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-butyl-5-ethenyl-
Database identifiers
- CAS
67050-81-1- PubChem CID
- 49246
- DTXSID
DTXSID80217351- Nikkaji
- J93.596D
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 303
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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