2,3-Dichloro-1-propanol

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:616-23-9

MDL number:MFCD00013676

EINECS number:210-469-5

RTECS number:UB1225000

BRN number:1731376

PubChem number:24862342

Physical property data

1. Properties: colorless liquid.

2. Boiling point (ºC, 101.3kPa): 183

3. Relative density (g/mL, 20ºC): 1.3616

4. Relative vapor density (g/mL, air=1): 4.45

5. Refractive index (n20ºC): 1.4819

6. Viscosity (mPa·s, 20ºC): 7.38

7. Flash point (ºC, closed cup): 74

8. Specific heat capacity (KJ/(kg·K), 20ºC, constant pressure): 1.60

9. Thermal conductivity (W/(m·K), 20ºC): 0.134

10. Relative evaporation rate (ether=1): >200

11. Vapor pressure (kPa, 20ºC): 0.0399

12. Vapor pressure (kPa, 28ºC): 0.1333

13. Solubility: soluble in water, solubility in water at 20℃ is about 12.7%, can be compared with Alcohol and ether are miscible.

14. Relative density (20℃, 4℃): 1.3615

15. Relative density (25℃, 4℃): 1.3558

Toxicological data

It is moderately toxic. Rat oral LD50: 90mg/kg.

Ecological data

This substance may be harmful to the environment, and special attention should be paid to water bodies.

Molecular structure data

1. Molar refractive index: 27.13

2. Molar volume (cm³/mol): 98.7

3. Isotonic specific volume (90.2K): 242.5

4. Surface tension (dyne/cm): 36.4

5. Polarizability (10^-24cm³): 10.75

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 0.8

2. Number of hydrogen bond donors: 1

3. Number of hydrogen bond acceptors: 1

4. Number of rotatable chemical bonds: 2

5. Number of tautomers: none

6. Topological molecule polar surface area 20.2

7. Number of heavy atoms: 6

8. Surface charge: 0

9. Complexity: 32

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. UncertainNumber of atomic stereocenters: 1

13. Determined number of stereocenters of chemical bonds: 0

14. Uncertain number of stereocenters of chemical bonds: 0

15 .Number of covalent bond units: 1

Properties and stability

The product may not decompose under normal temperature and pressure.

Storage method

Seal the secret container and store it in a sealed main container in a cool, dry place.

Synthesis method

None yet

Purpose

Used as solvent for nitrocellulose spray paint, paint, varnish, and celluloid adhesive. Also used to prepare ion exchange resin, etc.