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71933-03-4

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Basic Information
CAS No.: 71933-03-4
Name: Methyl 5-bromo-2-hydroxypyrimidine-4-carboxylate
Molecular Structure:
Molecular Structure of 71933-03-4 (Methyl 5-bromo-2-hydroxypyrimidine-4-carboxylate)
Formula: C6H5BrN2O3
Molecular Weight: 233.02
Synonyms: 4-Methoxycarbonyl-5-brompyrimidin-2-on;Methyl 5-bromo-2-hydroxypyrimidine-4-carboxylate;5-bromo-2-oxo-1,2-dihydro-pyrimidine-4-carboxylic acid methyl ester;
Density: 1.814 g/cm3
Boiling Point: 412.2 °C at 760 mmHg
Flash Point: 203.1 °C
PSA: 72.31000
LogP: 0.73130
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Specification

The cas register number of Methyl 5-bromo-2-hydroxypyrimidine-4-carboxylate is 71933-03-4. The Systematic name about this chemical is methyl 5-bromo-2-hydroxy-pyrimidine-4-carboxylate.

Physical properties about Methyl 5-bromo-2-hydroxypyrimidine-4-carboxylate are: (1)#H bond acceptors: 5; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 72.31Å2; (5)Index of Refraction: 1.597; (6)Molar Refractivity: 43.78 cm3; (7)Molar Volume: 128.3 cm3; (8)Polarizability: 17.35x10-24cm3; (9)Surface Tension: 65.9 dyne/cm; (10)Flash Point: 203.1 °C; (11)Enthalpy of Vaporization: 69.06 kJ/mol; (12)Boiling Point: 412.2 °C at 760 mmHg; (13)Vapour Pressure: 2.21E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: COC(=O)c1c(cnc(n1)O)Br
(2)InChI: InChI=1/C6H5BrN2O3/c1-12-5(10)4-3(7)2-8-6(11)9-4/h2H,1H3,(H,8,9,11)
(3)InChIKey: LQTKGJRZBOYLEY-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C6H5BrN2O3/c1-12-5(10)4-3(7)2-8-6(11)9-4/h2H,1H3,(H,8,9,11)
(5)Std. InChIKey: LQTKGJRZBOYLEY-UHFFFAOYSA-N