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6345-43-3

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Basic Information
CAS No.: 6345-43-3
Name: DIMETHYL PYRIMIDINE-4,6-DICARBOXYLATE
Article Data: 7
Molecular Structure:
Molecular Structure of 6345-43-3 (DIMETHYL PYRIMIDINE-4,6-DICARBOXYLATE)
Formula: C8H8N2O4
Molecular Weight: 196.163
Synonyms: 4,6-Pyrimidinedicarboxylicacid, dimethyl ester (6CI,7CI,9CI);Dimethyl 4,6-pyrimidinedicarboxylate;NSC44349;
EINECS: 929-172-3
Density: 1.293 g/cm3
Melting Point: 78-79 °C
Boiling Point: 305.7 °C at 760 mmHg
Flash Point: 138.7 °C
Risk Codes: 36/37/38
Safety: 26-36/37/39
PSA: 78.38000
LogP: 0.04980
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Specification

The 4,6-Pyrimidinedicarboxylicacid, 4,6-dimethyl ester, with the CAS registry number 6345-43-3, is also known as Methyl 6-(methoxycarbonyl)pyrimidine-4-carboxylate. This chemical's molecular formula is C8H8N2O4 and molecular weight is 196.1601. Its systematic name is called dimethyl pyrimidine-4,6-dicarboxylate.

Physical properties of 4,6-Pyrimidinedicarboxylicacid, 4,6-dimethyl ester: (1)ACD/LogP: 0.07; (2)#H bond acceptors: 6; (3)#Freely Rotating Bonds: 4; (4)Index of Refraction: 1.518; (5)Molar Refractivity: 45.98 cm3; (6)Molar Volume: 151.6 cm3; (7)Surface Tension: 50.9 dyne/cm; (8)Density: 1.293 g/cm3; (9)Flash Point: 138.7 °C; (10)Enthalpy of Vaporization: 54.61 kJ/mol; (11)Boiling Point: 305.7 °C at 760 mmHg; (12)Vapour Pressure: 0.000811 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)c1ncnc(C(=O)OC)c1
(2)InChI: InChI=1/C8H8N2O4/c1-13-7(11)5-3-6(8(12)14-2)10-4-9-5/h3-4H,1-2H3
(3)InChIKey: AJTJKDWVSIIOIR-UHFFFAOYAH