n,n’-dimethylethylenediamine n,n’-dimethylethylenediamine

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:110-70-3

mdl number:mfcd00008290

einecs number:203-793-3

rtecs number:kv4250000

brn number:878142

pubchem number:24893484

physical property data

1. characteristics: colorless liquid , with an amine-like smell.

2. density (g/ml,25℃): 0.818

3. relative vapor density (g/ml,air=1): undetermined

4. melting point (ºc): undetermined

5. boiling point (ºc,normal pressure): 118-119

6. boiling point (ºc,kpa): undetermined

7. refractive index: undetermined

8. flashpoint (ºc): 28

9. specific optical rotation (º): undetermined

10. autoignition point or ignition temperature (ºc): undetermined

11. vapor pressure (mmhg,ºc): undetermined

12. saturated vapor pressure (kpa, ºc): undetermined

13. heat of combustion (kj/mol): undetermined

14. critical temperature (ºc): undetermined

15. critical pressure (kpa): undetermined

16. oil and water (octanol/log value of the partition coefficient for water: undetermined

17. explosion limit (%,v/v): undetermined

acute toxicity: mouse peritoneum ld5o: 200mg/kg

ecological data

none yet

molecular structure data

5. molecular property data:

1. molar refractive index: 27.77

2. molar volume (m³/mol）：112.1

3. isotonic specific volume (90.2k):247.2

4. surface tension (dyne/cm):23.5

5. polarizability（10^-24cm³):11.00

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): none

2. number of hydrogen bond donors: 2

3. number of hydrogen bond acceptors: 2

4. number of rotatable chemical bonds: 3

5. number of tautomers: none

6. topological molecule polar surface area 24.1

7. number of heavy atoms: 6

8. surface charge: 0

9. complexity: 17.5

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

none yet

storage method

none yet

synthesis method

none yet

purpose

none yet

/sup>):11.00

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): none

2. number of hydrogen bond donors: 2

3. number of hydrogen bond acceptors: 2

4. number of rotatable chemical bonds: 3

5. number of tautomers: none

6. topological molecule polar surface area 24.1

7. number of heavy atoms: 6

8. surface charge: 0

9. complexity: 17.5

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

none yet

storage method

none yet

synthesis method

none yet

purpose

none yet