1,2,4-trivinylcyclohexane CAS 2855-27-8

Details:

Density 0.836g /mL at 25 °C(lit.)
Boiling point 85-88 °C20 mm Hg(lit.)
Melting point <-60ºC
Molecular formula C12H18
Molecular weight 162.27100
Flash point 156 °F
Accurate mass 162.14100
LogP 3.57690
Appearance properties Transparent colorless to slightly yellow liquid
Vapor pressure 0.508mmHg at 25°C
Refractive index n20/D 1.478(lit.)
Storage condition
Keep in a cool and dry environment

stability
It will not decompose when used and stored according to regulations.

Water soluble: methanol
Molecular structure
1, molar refractive index: 60.01

2. Molar volume (m3/mol) : 169.0

3. Isotropic volume (90.2K) : 404.5

4. Surface tension (dyne/cm) : 32.8

5. Polarization (10-24cm3) : 23.79

Computational chemistry
1. Reference value for calculating hydrophobic parameters (XlogP) :4.3

2. Number of hydrogen bond donors :0

3. Number of hydrogen bond receptors :0

4. Number of rotatable bonds :3

5. Number of tautomers: None

6. Topological molecular polar surface area is 0

7. Number of heavy atoms :12

8. Surface charge :0

9. Complexity :179

10. Number of isotope atoms :0

11. Determine the number of primary constitutive centers :0

12. Number of uncertain atomic orthotropic centers :3

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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