Barbituric acid, 5-isopropenyl-5-propyl-
Completing data — refresh the page later to see the latest
Basic information
- CAS
67051-37-0- Standard SMILES
C=C(C)C1(CCC)C(=O)NC(=O)NC1=O- InChIKey
XWDTXAXQNLVMKG-UHFFFAOYSA-N- Molecular formula
- C10H14N2O3
- Average molar mass
- 210.23 g/mol
- Monoisotopic mass
- 210.10044231
Names & identifiers
- Preferred name
- Barbituric acid, 5-isopropenyl-5-propyl-
- IUPAC
- 5-prop-1-en-2-yl-5-propyl-1,3-diazinane-2,4,6-trione
- English name
- 5-Isopropenyl-5-propyl-2,4,6(1H,3H,5H)-pyrimidinetrione
- Molecular weight
- 0
Names & synonyms
BARBITURIC ACID, 5-ISOPROPENYL-5-PROPYL-5-Isopropenyl-5-propylbarbituric acid67051-37-0BRN 0198940DTXSID302173614-24-00-01996 (Beilstein Handbook Reference)NSC 125734RefChem:116482DTXCID301398525-(prop-1-en-2-yl)-5-propyl-1,3-diazinane-2,4,6-trioneNSC125734NSC-125734
Show more names
5-Isopropenyl-5-propyl-2,4,6(1H,3H,5H)-pyrimidinetrione
2,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-methylethenyl)-5-propyl-
Database identifiers
- CAS
67051-37-0- PubChem CID
- 49307
- DTXSID
DTXSID30217361- Nikkaji
- J105.695F
Properties
Computed structural propertiesFilling in
- XLogP
- 1.6
- 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
- 327
Experimental & physicochemical properties
LogP1.15
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…