4-Ethylbenzyl chloride CAS1467-05-6

Details:

Density 1.0± 0.1g /cm3
Boiling point 217.1±9.0 °C at 760 mmHg
Melting point -21°C
Molecular formula C9H11Cl
Molecular weight 154.637
Flash point 83.5±4.3 °C
Accurate mass 154.054932
LogP 3.48
Vapor pressure 0.2±0.4 mmHg at 25°C
Refractive index of 1.520
Storage condition
Keep the storage device sealed and stored in a cool, dry place. Ensure that the workshop is well ventilated or vented

stability
Will not decompose if used and stored in accordance with specifications. No known hazardous reactions to avoid oxides

Molecular structure
1. Molar refractive index: 45.56

2. Molar volume (m3/mol) : 149.9

3. Isotropic specific volume (90.2K) : 359.1

4. Surface tension (dyne/cm) : 32.9

5, dielectric constant: no use

6, dipole distance (10-24cm 3) : No use

7. Polarization: 18.06

Computational chemistry
1. Reference value for calculating hydrophobic parameters (XlogP) :3.1

2. Number of hydrogen bond donors :0

3. Number of hydrogen bond receptors :0

4. Number of rotatable bonds :2

5. Number of tautomers: None

6. Topological molecular polar surface area is 0

7. Number of heavy atoms :10

8. Surface charge :0

9. Complexity :82.7

10. Number of isotope atoms :0

11. Determine the number of primary constitutive centers :0

12. Number of indeterminate atomic orthotropic centers :0

13. Determine the number of chemical bond constitutive centers :0

14. Number of uncertain bond constitutive centers :0

15. Number of covalent bond units :1

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