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Robenidine hydrochloride chemistry EINECS 247-307-8
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Boiling point 488.1ºC at 760 mmHg
Melting point 252-254°C
Molecular formula C15H14Cl3N5
Molecular weight 370.664
Flash point 249ºC
Accurate quality 369.031494
PSA 72.63000
LogP 5.15890
Appearance properties gray solid
Vapor pressure 1.12E-09mmHg at 25°C
Storage condition
0 to 6 ℃
Computational chemistry
1. Number of hydrogen bond donors: 3
2. Number of hydrogen bond receptors: 5
3. Number of rotatable bonds: 5
4. Number of tautomers: 2
5. Topological molecular polar surface area (TPSA) : 75.1
6. Number of heavy atoms: 23
7. Surface charge: 0
8. Complexity: 408
9. Number of isotope atoms: 0
10. Determine the number of atomic constitutive centers: 0
11. Number of uncertain atomic constitutive centers: 0
12. Determine the number of chemical bond structure centers: 3
13. Number of uncertain bond structure centers: 0
14. Number of covalent bond units: 2
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