N,N-diethylcarbamoyl chloride

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:88-10-8

MDL number:MFCD00000636

EINECS number:201-798-5

RTECS number:FD4025000

BRN number:506687

PubChem number:24859266

Physical property data

1. Properties: Light yellow irritating oily liquid.

2. Density (g/mL, 25/4℃): Undetermined

3. Relative vapor density (g/mL, air=1): Undetermined

4. Melting point (ºC): Not determined

5. Boiling point (ºC, normal pressure): Not determined

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

7. Refractive index: Undetermined

8. Flash point (ºC): Undetermined

9. Specific rotation (º): Undetermined

10. Autoignition point or ignition temperature (ºC): Undetermined

11. Vapor pressure (kPa, 25ºC): Undetermined

12. Saturation Vapor pressure (kPa, 60ºC): Undetermined

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: Undetermined

Toxicological data

None yet

Ecological data

None yet

Molecular structure data

1. Molar refractive index: 33.81

2. Molar volume (cm³/mol): 126.8

3. Isotonic specific volume (90.2K ): 300.2

4. Surface tension (dyne/cm): 31.4

5. Polarizability (10-24cm3): 13.40

Compute chemical data

1. Hydrophobic parameter calculation reference value (XlogP): 1.4

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 1

4. Number of rotatable chemical bonds: 2

5. Number of tautomers:

6. Topological molecular polar surface area (TPSA): 20.3

7. Number of heavy atoms: 8

8. Surface charge: 0

9. Complexity: 80.5

10. Number of isotope atoms: 0

11. Number of determined atomic stereocenters: 0

12. Uncertain atoms Number of stereocenters: 0

13. Number of determined stereocenters of chemical bonds: 0

14. Number of uncertain stereocenters of chemical bonds: 0

15. Number of covalent bond units: 1

Properties and stability

None yet

Storage method

This product should be sealed and stored in a cool place.

Synthesis method

Using ethylenediamine as raw material, perform formyl chlorination reaction with phosgene to obtain crude diethylaminoformyl chloride, which is deacidified And get the finished product.

Purpose

This product is a pharmaceutical and pesticide intermediate and is used in the production of the anti-bloodworm drug Haiqunsheng, the herbicide Herbicide, etc.