Basic information
- CAS
330859-97-7- Standard SMILES
CCOC(=O)C1C(C)=NC(=O)NC1C- InChIKey
QIGPSVDEHSYSGF-UHFFFAOYSA-N- Molecular formula
- C9H14N2O3
- Average molar mass
- 198.22 g/mol
- Monoisotopic mass
- 198.10044231
Names & identifiers
- Preferred name
- Ethyl 4,6-dimethyl-2-oxo-1,2,5,6-tetrahydropyrimidine-5-carboxylate
- IUPAC
- ethyl 4,6-dimethyl-2-oxo-5,6-dihydro-1H-pyrimidine-5-carboxylate
- English name
- 5-Pyrimidinecarboxylicacid,1,2,5,6-tetrahydro-4,6-dimethyl-2-oxo-,ethylester(9CI)
- Molecular formula
- C9H14N2O3
- Molecular weight
- 0
Names & synonyms
330859-97-7ethyl 4,6-dimethyl-2-oxo-1,2,5,6-tetrahydropyrimidine-5-carboxylateTimTec1_002581SCHEMBL19461726HMS1541F07AKOS024280962NCGC00173967-01ST036961DB-108630ethyl 4,6-dimethyl-2-oxo-3,4,5-trihydropyrimidine-5-carboxylateethyl4,6-dimethyl-2-oxo-1,2,5,6-tetrahydropyrimidine-5-carboxylate5-Pyrimidinecarboxylicacid,1,2,5,6-tetrahydro-4,6-dimethyl-2-oxo-,ethylester(9CI)
Database identifiers
- CAS
330859-97-7- PubChem CID
- 3452891
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 67.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 286
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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