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Cas Database |
| Name |
Methyl pyrimidine-4-carboxylate |
EINECS | N/A |
| CAS No. | 2450-08-0 | Density | 1.213 g/cm3 |
| PSA | 52.08000 | LogP | 0.26320 |
| Solubility | N/A | Melting Point |
63-68 °C |
| Formula | C6H6N2O2 | Boiling Point | 224.3 °C at 760 mmHg |
| Molecular Weight | 138.126 | Flash Point | 89.4 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Methyl4-pyrimidinecarboxylate;NSC 78314; |
Article Data | 8 |
Methyl pyrimidine-4-carboxylate Chemical Properties
IUPAC Name: Methyl pyrimidine-4-carboxylate
Following is the structure of 4-Pyrimidinecarboxylicacid, methyl ester (CAS NO.2450-08-0):
Empirical Formula: C6H6N2O2
Molecular Weight: 138.124 g/mol
Index of Refraction: 1.513
Molar Refractivity: 34.2 cm3
Molar Volume: 113.7 cm3
Density: 1.213 g/cm3
Flash Point: 89.4 °C
Melting point: 63-68 °C
Surface Tension: 48.6 dyne/cm
Enthalpy of Vaporization: 46.08 kJ/mol
Boiling Point: 224.3 °C at 760 mmHg
Vapour Pressure of 4-Pyrimidinecarboxylicacid, methyl ester (CAS NO.2450-08-0): 0.092 mmHg at 25 °C
Product Categories of 4-Pyrimidinecarboxylicacid, methyl ester (CAS NO.2450-08-0): PYRIMIDINE; Pyridines, Pyrimidines, Purines and Pteredines; Esters; Pyrazines, Pyrimidines & Pyridazines
Canonical SMILES: COC(=O)C1=NC=NC=C1
InChI: InChI=1S/C6H6N2O2/c1-10-6(9)5-2-3-7-4-8-5/h2-4H,1H3
InChIKey: GXZQHMHLHHUHAM-UHFFFAOYSA-N
Methyl pyrimidine-4-carboxylate Specification
4-Pyrimidinecarboxylicacid, methyl ester, its cas register number is 2450-08-0. It also can be called Methyl pyrimidine-4-carboxylate ; Pyrimidine-4-carboxylic acid methyl ester ; and NSC 78314 .
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