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Basic Information
CAS No.: 57054-92-9
Name: 5-BROMO-2-CHLORO-4-METHOXYPYRIMIDINE
Article Data: 16
Molecular Structure:
Molecular Structure of 57054-92-9 (5-BROMO-2-CHLORO-4-METHOXYPYRIMIDINE)
Formula: C5H4BrClN2O
Molecular Weight: 223.457
Synonyms: 5-Bromo-2-chloro-4-methoxypyrimidine;
Density: 1.745 g/cm3
Melting Point: 73-75 °C(Solv: hexane (110-54-3))
Boiling Point: 323.6 °C at 760 mmHg
Flash Point: 149.5 °C
Hazard Symbols: IrritantXi
PSA: 35.01000
LogP: 1.90110
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Specification

The CAS register number of Pyrimidine,5-bromo-2-chloro-4-methoxy- is 57054-92-9. The systematic name about this chemical is 5-bromo-2-chloro-4-methoxypyrimidine. The molecular formula about this chemical is C5H4BrClN2O and the molecular weight is 223.46. It belongs to the following product categories which include Building Blocks; Pyrimidine and so on.

Physical properties about Pyrimidine,5-bromo-2-chloro-4-methoxy- are: (1)ACD/LogP: 0.85 ; (2)#H bond acceptors: 3; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 35.01Å2; (5)Index of Refraction: 1.565; (6)Molar Refractivity: 41.69 cm3; (7)Molar Volume: 128 cm3; (8)Polarizability: 16.53x10-24cm3; (9)Surface Tension: 48.9 dyne/cm; (10)Flash Point: 149.5 °C; (11)Enthalpy of Vaporization: 54.31 kJ/mol; (12)Boiling Point: 323.6 °C at 760 mmHg; (13)Vapour Pressure: 0.00049 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1nc(OC)c(Br)cn1
(2)InChI: InChI=1/C5H4BrClN2O/c1-10-4-3(6)2-8-5(7)9-4/h2H,1H3
(3)InChIKey: ZPPORMCRNCNFGX-UHFFFAOYAM