tert-Butyl uracil-1-ylacetate
Basic information
- CAS
257869-92-4- Standard SMILES
CC(C)(C)OC(=O)Cn1ccc(=O)[nH]c1=O- InChIKey
QLKHDTKOLCBXGQ-UHFFFAOYSA-N- Molecular formula
- C10H14N2O4
- Average molar mass
- 226.23 g/mol
- Monoisotopic mass
- 226.09535693
Names & identifiers
- Preferred name
- tert-Butyl uracil-1-ylacetate
- IUPAC
- tert-butyl 2-(2,4-dioxopyrimidin-1-yl)acetate
- English name
- tert-butyl uracil-1-ylacetate
- Molecular formula
- C10H14N2O4
- Molecular weight
- 226.23
Names & synonyms
tert-Butyl uracil-1-ylacetate257869-92-4tert-butyl 2-(2,4-dioxopyrimidin-1-yl)acetatetert-Butyl 2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)acetateMaybridge4_000506DTXSID901174619HMS1522G22CCG-41007AKOS018719744IDI1_031088NCGC00177506-01SR-01000631113-1
Show more names
1(2H)-Pyrimidineacetic acid, 3,4-dihydro-2,4-dioxo-, 1,1-dimethylethyl ester
BRD-K63391003-001-01-7tert-Butyl (2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)acetate1,1-Dimethylethyl 3,4-dihydro-2,4-dioxo-1(2H)-pyrimidineacetate
Database identifiers
- CAS
257869-92-4- PubChem CID
- 2802880
- DTXSID
DTXSID901174619
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 354
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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