Bis(2-chloroisopropyl)ether Bis(2-chloroisopropyl)ether
Structural formula
| Business number | 02XK |
|---|---|
| Molecular formula | C6H12Cl2O |
| Molecular weight | 171.06 |
| label |
Fungicide |
Numbering system
CAS number:108-60-1
MDL number:None
EINECS number:203-598-3
RTECS number:None
BRN number:None
PubChem ID:None
Physical property data
1. Properties: colorless liquid.
2. Density (g/mL, 25℃): 1.11
3. Relative vapor density (g/mL, air=1): 6.0
4. Melting point (ºC): Undetermined
5. Boiling point (ºC, normal pressure): 187.8
6. Boiling point (ºC, mm Hg): Undetermined
7. Refractive index (D20): Undetermined
8. Flash point (ºC): 85
9. Specific rotation (ºC): Undetermined
10. Autoignition point or ignition temperature (ºC): Undetermined
11. Vapor pressure (mmHg, ºC): Undetermined
12. Saturated vapor pressure (kPa, 20ºC): 0.01
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
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17. Explosion upper limit (%, V/V): Undetermined
18. Explosion lower limit (%, V/V): Undetermined
19. Dissolution Properties: Insoluble in water, miscible in most organic solvents.
Toxicological data
1. Acute toxicity: Rat oral LD50: 240 mg/kg
Mouse oral LD5O: 296 mg/kg
Ecological data
1. Biodegradability: Can be biodegraded in the environment.
2. Non-biodegradability: not easily photolyzed and hydrolyzed.
3. Bioconcentration or bioaccumulation: easy to migrate on land, can penetrate into groundwater, and can be volatile. In water bodies, the half-lives in rivers and lakes are 3.1 days and 59 days respectively. Slowly biodegrades. It exists almost in vapor state in the atmosphere and can react with hydroxyl groups. Not easy to enrich.
4. Other harmful effects: Migration: Easy to migrate. Adsorption: Adsorption coefficient (calculated value) 73, easy to migrate. Evaporation: half-life in simulated rivers is 13.9 hours; half-life in simulated ponds is 6.6 days; volatilization half-life in water is 1.37 days.
Molecular structure data
1. Molar refractive index: 41.22
2. Molar volume (cm3/mol): 156.8
3. Isotonic specific volume (90.2K ): 357.6
4. Surface tension (dyne/cm): 27.0
5. Polarizability (10-24cm3): 16.34
Compute chemical data
1. Hydrophobic parameter calculation reference value (XlogP): 2.1
2. Number of hydrogen bond donors: 0
3. Number of hydrogen bond acceptors: 1
4. Number of rotatable chemical bonds: 4
5. Number of tautomers: None
6. Topological molecule polar surface area 9.2
7. Number of heavy atoms: 9
8. Surface charge: 0
9. Complexity: 60.1
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 0
12. Uncertain number of atomic stereocenters: 2
13. Determined number of chemical bond stereocenters: 0
14. Uncertain chemical bond stereocenters Quantity: 0
15. Quantity of covalent bond units: 1
Properties and stability
Avoid contact with strong oxidants and acids.
Storage method
Stored in a cool, ventilated warehouse. Keep away from fire and heat sources. They should be stored separately from oxidants, acids, and food chemicals, and avoid mixed storage. Equipped with the appropriate variety and quantity of fire equipment. The storage area should be equipped with emergency release equipment and suitable containment materials.
Synthesis method
None
Purpose
Used as a solvent for grease, wax, and grease, as well as a paint remover, detergent, and extractant.