1,3-Bis(4-piperidyl)propane CAS16898-52-5

Details:

The density is 0.894 g/cm3
Boiling point 327°C
Melting point 65-68.5 °C(lit.)
Molecular formula C13H26N2
Molecular weight 210.35900
Flash point 327°C
Accurate mass 210.21000
PSA 24.06000
LogP 2.81350
Appearance character solid; White to Light yellow powder to crystal
Vapor pressure 0.00306mmHg at 25°C
Refractive index 1.491
Storage condition
Room temperature closed light, ventilated and dry

stability
Stable at normal temperature and pressure

Materials to avoid: oxides
Water solubility: soluble
Molecular structure
Molecular property data:

1. Molar refractive index: 64.78

2. Molar volume (m3/mol) : 235.0

3. Isotropic volume (90.2K) : 562.3

4. Surface tension (3.0 dyne/cm) : 32.7

5. Polarizability (0.5 10-24cm 3) : 25.68

Computational chemistry
1. Reference value for calculating hydrophobic parameters (XlogP) :2.5

2. Number of hydrogen bond donors :2

3. Number of hydrogen bond receptors :2

4. Number of rotatable bonds :4

5. Number of tautomers: None

6. Topological molecular polar surface area 24.1

7. Number of heavy atoms :15

8. Surface charge :0

9. Complexity :140

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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