Isopropylbenzylamine/Benzylisopropylamine 99.99% crytals isopropylbenzylamine Pharmaceutica

Density 0.9± 0.1g /cm3
Boiling point 200.0±0.0 °C at 760 mmHg
Molecular formula C10H15N
Molecular weight 149.233
Flash point 87.8±0.0 °C
Accurate mass 149.120453
PSA 12.03000
LogP 2.40
Appearance properties Colorless transparent liquid
Vapor pressure 0.3±0.3 mmHg at 25°C
Refractive index 1.503
Storage conditions Store in a cool, ventilated warehouse. Keep away from fire and heat. Should be stored separately from oxidizer, do not mix storage. Equipped with the corresponding variety and quantity of fire equipment. The storage area should be equipped with leak emergency treatment equipment and suitable containment materials.
stability
Avoid contact with strong oxidants.

Molecular structure
1. Molar refractive index: 48.62

2, molar volume (cm3/mol) : 164.4

3. Isotonic specific volume (90.2K) : 388.7

4, surface tension (dyne/cm) : 31.2

5. Dielectric constant:

6, dipole distance (10-24cm3) :

7. Polarization: 19.27

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

2. Number of hydrogen bond donors :1

3. Number of hydrogen bond receptors :1

4. Number of rotatable bonds :3

5. Number of tautomers: None

6. Topological molecular polar surface area 12

7. Number of heavy atoms :11

8. Surface charge :0

9. Complexity :93

10. Number of isotope atoms :0

11. Determine the number of protonic centers :0

12. Number of uncertain atomic stereocentes :0

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

14. Number of uncertain chemical bond stereocenter :0

15. Number of covalent bond units :1

more
1. Properties: Colorless to yellow oily liquid.

2. Density (g/mL,25/4℃) : 0.895

3. Relative vapor density (g/mL, air =1) : not determined

4. Melting point (ºC) : not determined

5. Boiling point (ºC, atmospheric pressure) : 200

6. Boiling point (ºC,5.2kPa) : not determined

7. Refractive index: 1.5020

8. Flash point (ºC) : 87

9. Specific rotation (º) : not determined

10. Spontaneous ignition point or ignition temperature (ºC) : not determined

11. Vapor pressure (kPa,25ºC) : not determined

12. Saturated vapor pressure (kPa,60ºC) : not determined

13. Heat of combustion (KJ/mol) : not determined

14. Critical temperature (ºC) : not determined

15. Critical pressure (KPa) : not determined

16. Value of oil-water (octanol/water) distribution coefficient: not determined

17. Upper explosion limit (%,V/V) : not determined

18. Lower explosive limit (%,V/V) : not determined