Quality: 353.28500

LogP: 7.37600

Physical and chemical properties

Density: 0.989 g/cm3

Melting point: -5 º C

Boiling point: 100 º C

Flash point:>100 º C

Storage conditions: The warehouse is ventilated and low-temperature dry, and stored separately from food raw materials

purpose

An important cationic quaternary ammonium salt surfactant widely used in personal care, shampoo, conditioner and other products, with good anti-static, softening, and anti-corrosion effects. It can also be used in industries such as sterilization, printing and dyeing auxiliaries, and fabric washing.

toxicology data 

1. Acute toxicity: LD50 in rats (skin): 1420 mg/kg

Mouse (oral) LD50: 150 mg/kg

Mouse (intravenous) LD50: 16 mg/kg

Due to the LD50 of 3000 mg/kg of table salt, the acute toxicity of BPA is the same as that of table salt.

2. Acute toxicity:

Oral LD50 150mg/kg (mus)

240 mg/kg (rat)

Skin LD50 1560mg/kg (rat)

Skin irritation rate 50mg/24h (rbt)

Irritating eyes Severe 50ug (hmn)

1mg/24H (rbt)

Main irritant effects:

On the skin: Causing corrosive effects on the skin and mucous membranes.

On the eyes: Strong corrosive effects

Sensitizing effect: There is no known sensitization effect.

Ecological data

It is harmful to water. Do not let the product come into contact with groundwater or sewage systems. Even a small amount of this product infiltrating groundwater can cause harm to drinking water and be toxic to organic substances in the water. Highly toxic to fish. Do not discharge materials into the surrounding environment without government permission.

Computational Chemistry Data

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

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond receptors: 1

4. Number of rotatable chemical bonds: 11

5. Number of tautomers: None

6. Topological molecule polarity surface area 0

7. Number of heavy atoms: 21

8. Surface charge: 0

9. Complexity: 216

10. Isotope atomic number: 0

11. Determine the number of atomic structure centers: 0

12. Number of uncertain atomic structure centers: 0

13. Determine the number of chemical bond stereocenters: 0

14. Uncertain number of chemical bond stereocenters: 0

15. Number of covalent bond units: 2