n,n-diisopropylethylenediamine n,n-diisopropylethylenediamine

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:121-05-1

mdl number:mfcd00015015

einecs number:204-447-4

rtecs number:kv4200000

brn number:1734800

pubchem number:24863945

physical property data

none

toxicological data

1. acute toxicity: mouse peritoneal cavity ld50: 200mg/kg

ecological data

none

molecular structure data

1. molar refractive index: 46.28

2. molar volume (cm³/mol): 172.2

3. isotonic specific volume (90.2k ): 399.9

4. surface tension (dyne/cm): 29.0

5. dielectric constant:

6. dipole moment (10^-24cm³):

7. polarizability: 18.34

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): 0.9

2. number of hydrogen bond donors: 1

3. number of hydrogen bond acceptors: 2

4. number of rotatable chemical bonds: 4

5. number of tautomers: none

6. topological molecule polar surface area 29.3

7. number of heavy atoms: 10

8. surface charge: 0

9. complexity: 71.3

10. number of isotope atoms: 0

11. determine the number of atomic stereocenters: 0

12. uncertain number of atomic stereocenters: 0

13. determine the number of chemical bond stereocenters: 0

14. number of uncertain chemical bond stereocenters: 0

15. number of covalent bond units: 1

properties and stability

1. basic properties

this product is a colorless liquid. boiling point 169-171℃.

storage method

none

synthesis method

none

purpose

none