Barbituric acid, 5-isopentyl-5-methyl-
Basic information
- CAS
67051-30-3- Standard SMILES
CC(C)CCC1(C)C(=O)NC(=O)NC1=O- InChIKey
RGFAQSMJEZWLDS-UHFFFAOYSA-N- Molecular formula
- C10H16N2O3
- Average molar mass
- 212.25 g/mol
- Monoisotopic mass
- 212.11609238
Names & identifiers
- Preferred name
- Barbituric acid, 5-isopentyl-5-methyl-
- IUPAC
- 5-methyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione
- English name
- 5-Isopentyl-5-methylbarbituric acid
- Molecular weight
- 0
Names & synonyms
BARBITURIC ACID, 5-ISOPENTYL-5-METHYL-5-Isopentyl-5-methylbarbituric acid67051-30-3BRN 0201783DTXSID002173584-24-00-01938 (Beilstein Handbook Reference)NSC 32368RefChem:320858DTXCID001398495-methyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trioneNSC32368NSC-32368
Show more names
5-Isopentyl-5-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione
2,6(1H,3H,5H)-Pyrimidinetrione, 5-methyl-5-(3-methylbutyl)-
Database identifiers
- CAS
67051-30-3- PubChem CID
- 49300
- DTXSID
DTXSID00217358- Nikkaji
- J105.687E
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 290
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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