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Methyl 2,4-dimethoxypyrimidine-5-carboxylate

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Name

Methyl 2,4-dimethoxypyrimidine-5-carboxylate

EINECS N/A
CAS No. 15400-58-5 Density 1.225 g/cm3
PSA 70.54000 LogP 0.28040
Solubility N/A Melting Point N/A
Formula C8H10N2O4 Boiling Point 327.808 °C at 760 mmHg
Molecular Weight 198.176 Flash Point 152.053 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 15400-58-5 (Methyl 2,4-dimethoxypyrimidine-5-carboxylate) Hazard Symbols N/A
Synonyms

5-pyrimidinecarboxylic acid, 2,4-dimethoxy-, methyl ester;

Article Data 5

Methyl 2,4-dimethoxypyrimidine-5-carboxylate Specification

The Methyl 2,4-dimethoxypyrimidine-5-carboxylate, with the CAS registry number 15400-58-5, is also known as 5-Pyrimidinecarboxylic acid, 2,4-dimethoxy-, methyl ester. This chemical's molecular formula is C8H10N2O4 and molecular weight is 198.176. Its systematic name is called methyl 2,4-dimethoxypyrimidine-5-carboxylate.

Physical properties of Methyl 2,4-dimethoxypyrimidine-5-carboxylate: (1)ACD/LogP: -1.07; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 3; (5)ACD/BCF (pH 7.4): 3; (6)ACD/KOC (pH 5.5): 81; (7)ACD/KOC (pH 7.4): 81; (8)#H bond acceptors: 6; (9)#Freely Rotating Bonds: 4; (10)Index of Refraction: 1.5; (11)Molar Refractivity: 47.566 cm3; (12)Molar Volume: 161.778 cm3; (13)Surface Tension: 42.786 dyne/cm; (14)Density: 1.225 g/cm3; (15)Flash Point: 152.053 °C; (16)Enthalpy of Vaporization: 57.014 kJ/mol; (17)Boiling Point: 327.808 °C at 760 mmHg; (18)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: COc1nc(OC)c(cn1)C(=O)OC
(2)InChI: InChI=1/C8H10N2O4/c1-12-6-5(7(11)13-2)4-9-8(10-6)14-3/h4H,1-3H3
(3)InChIKey: HDQHTPWKNFCTDN-UHFFFAOYAN

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