Basic information
- CAS
35149-52-1- Standard SMILES
CCO/C=C(\C(=O)OCC)c1cc(=O)[nH]c(=O)[nH]1- InChIKey
NBLPAPPYCIFWPX-SREVYHEPSA-N- Molecular formula
- C11H14N2O5
- Average molar mass
- 254.24 g/mol
- Monoisotopic mass
- 254.09027155
Names & identifiers
- Preferred name
- ethyl (Z)-2-(2,4-dioxo-1H-pyrimidin-6-yl)-3-ethoxyprop-2-enoate
- IUPAC
- ethyl (Z)-2-(2,4-dioxo-1H-pyrimidin-6-yl)-3-ethoxyprop-2-enoate
- English name
- ethyl 2-(2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinyl)-3-ethoxyacrylate
- Molecular formula
- C11H14N2O5
- Molecular weight
- 254.24
Names & synonyms
ethyl 2-(2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinyl)-3-ethoxyacrylateethyl (Z)-2-(2,4-dioxo-1H-pyrimidin-6-yl)-3-ethoxyprop-2-enoateAC-907/34132005
Database identifiers
- CAS
35149-52-1- PubChem CID
- 7103269
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 93.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 425
Physicochemical properties
- Density
- 1.254 · 1.254±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 6.835 · 6.835±0.10(predicted)
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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