Trimethylstearylammonium chioride Trimethylstearylammonium chioride

Structural formula

• Numbering system
• Physical property data
• Toxicological data
• Ecological data
• Molecular structure data
• Computing chemical data
• More
  • Properties and Stability
  • Storage method
  • Synthesis method
  • Purpose

Numbering system

CAS number:112-03-8

MDL number:MFCD00050188

EINECS number:203-929-1

RTECS number:BT1750000

BRN number:None

PubChem ID:None

Physical property data

1. Properties: white waxy substance.

2. Density (g/mL, 30℃): 0.884

3. Relative density (20ºC/4 ºC): 0.884

4. Melting point ( ºC): Not determined

5. Boiling point (ºC, 1.33kPa): Not determined

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

7. Refractive index: Undetermined

8. Flash point (ºC): 180

9. Specific rotation (º): Undetermined

10. Autoignition point or ignition temperature (ºC): Not determined

11. Vapor pressure (mmHg, ºC): Not determined

12. Saturated vapor pressure (kPa, ºC): Not determined Determined

13. Heat of combustion (KJ/mol): Undetermined

14. Critical temperature (ºC): Undetermined

15. Critical pressure (KPa ): Undetermined

16. Log value of oil-water (octanol/water) partition coefficient: Undetermined

17. Explosion upper limit (%, V/V): Undetermined

18. Lower explosion limit (%, V/V): Undetermined

19. Solubility: Easily soluble in water.

Toxicological data

None yet

Ecological data

None yet

Molecular structure data

None yet

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): None

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 1

4. Number of rotatable chemical bonds: 17

5. Number of tautomers: none

6. Topological molecule polar surface area 0

7. Number of heavy atoms: 23

8. Surface charge: 0

9. Complexity: 204

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain atomic stereocenters�Quantity: 0

13. Determine the number of stereocenters of chemical bonds: 0

14. Uncertain number of stereocenters of chemical bonds: 0

15. Covalent Number of key units: 2

Properties and stability

1. It has excellent stability, surface activity, emulsification, sterilization, disinfection, softness and antistatic properties.

Storage method

1. Store in a cool, ventilated warehouse. Keep away from fire and heat sources. Protect from direct sunlight. 2. Keep container sealed. They should be stored separately from oxidants and acids, and avoid mixed storage. Equipped with the appropriate variety and quantity of fire equipment. 3. The storage area should be equipped with leakage emergency treatment equipment and suitable containment materials.

Synthesis method

1. Pour tertiary amine into the pressure kettle, add an appropriate amount of isopropyl alcohol and no reaction medium, and then add a small amount of sodium hydroxide as a catalyst. Replace the air in the kettle with nitrogen, raise the temperature to 50°C, and introduce 1% (mass) excess of methyl chloride than the theoretical amount. Close the autoclave. React at 0.5 MPa for 4 hours. The reaction is over. After desalination, dilute with water to the required concentration. The finished product is ready for canning.

Purpose

1. Used as antistatic agent for textile fibers, hair conditioner, and emulsifier for asphalt, rubber and silicone oil. And widely used as disinfectant.

2.Generally, those with active substances greater than 3 4% are used as asphalt emulsifiers and soil waterproofing agents. Other products are used as antistatic agents for synthetic fibers, additives for oil paint cosmetics, hair conditioners, disinfectants, fabric fiber softeners, soft detergents, silicone oil emulsifiers, etc.