N-Vinylcaprolactam CAS2235-00-9

Details:

Light yellow powder density 1.0± 0.1g /cm3
Boiling point 254.7±7.0 °C at 760 mmHg
Melting point 35-38 °C (dec.)(lit.)
Molecular formula C8H13NO
Molecular weight 139.195
Flash point 112.5±9.4 °C
Accurate mass 139.099716
PSA 20.31000
LogP is 1.50
Appearance character light yellow powder
Vapor pressure 0.0±0.5 mmHg at 25°C
Refractive index 1.548
Storage condition
Keep the container sealed, place in a tight container, and store in a cool, dry place

stability
Oxide avoidance

Molecular structure
1. Molar refractive index: 42.14

2. Molar volume (m3/mol) : 132.6

3. Isotropic volume (90.2K) : 341.4

4. Surface tension (dyne/cm) : 43.9

5. Polarization (10-24cm 3) : 16.70

Computational chemistry
1. Reference value for calculating hydrophobic parameters (XlogP) : None

2. Number of hydrogen bond donors :0

3. Number of hydrogen bond receptors :1

4. Number of rotatable bonds :1

5. Number of tautomers :2

6. Topological molecular polar surface area 20.3

7. Number of heavy atoms :10

8. Surface charge :0

9. Complexity :142

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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