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2-benzyl-4,5-dihydro-1H-imidazole chlorhydrate 2-benzyl-4,5-dihydro-1H-imidazole,hydrochloride 2-benzyl-4,5-dihydro-1H-imidazole chlorhydrate (1:1)
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♦ High purity, all above 98.5%, no impurities after dissolution
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♦ More than 1000 m2 of factory production line to ensure stable supply
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Density 1.09g/cm3
The boiling point is 338.2ºC at 760mmHg
Melting point 172-176 °C
Molecular formula C10H13ClN2
Molecular weight 196.677
Flash point 158.3ºC
Accurate mass 196.076721
PSA 24.39,000
LogP 1.79720
Appearance properties light yellow crystalline solid
Storage condition
This product should be kept sealed.
Stability Hygroscopic
Molecular structure
1. Molar refractive index: 49.63
2. Molar volume (m3/mol) : 145.8
3. Isotropic specific volume (90.2K) : 370.3
4. Surface tension (dyne/cm) : 41.5
5. Polarization (10-24cm 3) : 19.67
Computational chemistry
1, calculate the reference value of hydrophobic parameter (XlogP) :
2. Number of hydrogen bond donors: 2
3. Number of hydrogen bond receptors: 2
4. Number of rotatable bonds: 2
5. Number of tautomers:
6. Topological molecular polar surface area (TPSA) : 24.4
7. Number of heavy atoms: 13
8. Surface charge: 0
9. Complexity: 169
10. Number of isotope atoms: 0
11. Determine the number of atomic constitutive centers: 0
12. Number of uncertain atomic constitutive centers: 0
13. Determine the number of chemical bond structure centers: 0
14. Number of uncertain chemical bond structure centers: 0
15. Number of covalent bond units: 2
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