Basic information
- CAS
67051-34-7- Standard SMILES
C=CC1(CCC(C)C)C(=O)NC(=O)NC1=O- InChIKey
JYKMNZIAWVDMDX-UHFFFAOYSA-N- Molecular formula
- C11H16N2O3
- Average molar mass
- 224.26 g/mol
- Monoisotopic mass
- 224.11609238
Names & identifiers
- Preferred name
- Barbituric acid, 5-isopentyl-5-vinyl-
- IUPAC
- 5-ethenyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione
- English name
- 5-Isopentyl-5-vinylbarbituric acid
- Molecular weight
- 0
Names & synonyms
5-Isopentyl-5-vinylbarbituric acidBARBITURIC ACID, 5-ISOPENTYL-5-VINYL-BRN 022711167051-34-7DTXSID602173595-24-09-00230 (Beilstein Handbook Reference)RefChem:320859DTXCID101398505-ethenyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione5-Isopentyl-5-vinyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Database identifiers
- CAS
67051-34-7- PubChem CID
- 49304
- DTXSID
DTXSID60217359- Nikkaji
- J105.692A
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 327
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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