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| CAS No.: | 65202-58-6 |
|---|---|
| Name: | 3-bromo-6-methylpyridazine |
| Article Data: | 4 |
| Molecular Structure: | |
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| Formula: | C5H5BrN2 |
| Molecular Weight: | 173.012 |
| Synonyms: | 3-Bromo-6-methylpyridazine; |
| Density: | 1.597 g/cm3 |
| Boiling Point: | 285.041 °C at 760 mmHg |
| Flash Point: | 126.188 °C |
| PSA: | 25.78000 |
| LogP: | 1.54750 |
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Specification
The Pyridazine, 3-bromo-6-methyl- is an organic compound with the formula C5H5BrN2. The systematic name of this chemical is 3-bromo-6-methylpyridazine and CAS registry number is 65202-58-6. In addition, the molecular weight is 173.01.
The other characteristics of Pyridazine, 3-bromo-6-methyl- can be summarized as: (1)ACD/LogP: 0.54; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 25.78 Å2; (7)Index of Refraction: 1.558; (8)Molar Refractivity: 34.95 cm3; (9)Molar Volume: 108.341 cm3; (10)Polarizability: 13.855×10-24 cm3; (11)Surface Tension: 47.025 dyne/cm; (12)Density: 1.597 g/cm3; (13)Flash Point: 126.188 °C; (14)Enthalpy of Vaporization: 50.303 kJ/mol; (15)Boiling Point: 285.041 °C at 760 mmHg; (16)Vapour Pressure: 0.005 mmHg at 25°C.
People can use the following data to convert to the molecule structure.
1. SMILES:Brc1nnc(cc1)C
2. InChI:InChI=1/C5H5BrN2/c1-4-2-3-5(6)8-7-4/h2-3H,1H3
3. InChIKey:RACIHBXDZONTQJ-UHFFFAOYAW
4. Std. InChI:InChI=1S/C5H5BrN2/c1-4-2-3-5(6)8-7-4/h2-3H,1H3
5. Std. InChIKey:RACIHBXDZONTQJ-UHFFFAOYSA-N