Ethyl 2-(4-methylphenyl)pyrimidine-5-carboxylate
Basic information
- CAS
65586-64-3- Standard SMILES
CCOC(=O)c1cnc(-c2ccc(C)cc2)nc1- InChIKey
FGVZKUPPTFKFRY-UHFFFAOYSA-N- Molecular formula
- C14H14N2O2
- Average molar mass
- 242.27 g/mol
- Monoisotopic mass
- 242.10552769
Names & identifiers
- Preferred name
- Ethyl 2-(4-methylphenyl)pyrimidine-5-carboxylate
- IUPAC
- ethyl 2-(4-methylphenyl)pyrimidine-5-carboxylate
- English name
- ethyl 2-(4-methylphenyl)pyrimidine-5-carboxylate
- Molecular formula
- C14H14N2O2
- Molecular weight
- 242.27
Names & synonyms
65586-64-3ETHYL 2-(P-TOLYL)PYRIMIDINE-5-CARBOXYLATEethyl 2-(4-methylphenyl)pyrimidine-5-carboxylateDTXSID90647963SB59827DB-360347ETHYL2-(P-TOLYL)PYRIMIDINE-5-CARBOXYLATE2-(4-METHYLPHENYL)-5-PYRIMIDINECARBOXYLIC ACID ETHYL ESTER5-Pyrimidinecarboxylic acid, 2-(4-methylphenyl)-, ethyl ester
Database identifiers
- CAS
65586-64-3- PubChem CID
- 24903643
- DTXSID
DTXSID90647963
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 267
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Compound notes
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