Ethyl 4-(2,5-dimethoxyphenyl)-1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-5-pyrimidinecarboxylate
Basic information
- CAS
301319-40-4- Standard SMILES
CCOC(=O)C1=C(C)N(C)C(=O)NC1c1cc(OC)ccc1OC- InChIKey
XGIUSBSTDZEDJG-UHFFFAOYSA-N- Molecular formula
- C17H22N2O5
- Average molar mass
- 334.4 g/mol
- Monoisotopic mass
- 334.15287181
Names & identifiers
- Preferred name
- Ethyl 4-(2,5-dimethoxyphenyl)-1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-5-pyrimidinecarboxylate
- IUPAC
- ethyl 6-(2,5-dimethoxyphenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate
- English name
- ethyl 4-[2,5-bis(methyloxy)phenyl]-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
- Molecular formula
- C17H22N2O5
- Molecular weight
- 334.37
Names & synonyms
301319-40-4Ethyl 4-(2,5-dimethoxyphenyl)-1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-5-pyrimidinecarboxylateRefChem:343653ethyl 4-(2,5-dimethoxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylateOprea1_189181Oprea1_204627DTXSID301120814STK034193AKOS000637397AKOS021984615ethyl 6-(2,5-dimethoxyphenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylateST013297
Show more names
5-Pyrimidinecarboxylic acid, 4-(2,5-dimethoxyphenyl)-1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-, ethyl ester
AG-690/09401045SR-01000404175SR-01000404175-1ethyl 6-(2,5-dimethoxyphenyl)-3,4-dimethyl-2-oxo-1,3,6-trihydropyrimidine-5-ca rboxylateethyl 4-[2,5-bis(methyloxy)phenyl]-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Database identifiers
- CAS
301319-40-4- PubChem CID
- 2855342
- DTXSID
DTXSID301120814
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 77.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 519
Physicochemical properties
- Boiling point
- 517.4 · 517.4±50.0 °C(Predicted)
- Density
- 1.17 · 1.170±0.06 g/cm3(Predicted)
- pka
- 11.01 · 11.01±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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