n,n-dimethylhexadecylamine n,n-dimethylhexadecylamine

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:112-69-6

mdl number:mfcd00015086

einecs number:203-997-2

rtecs number:mm0750000

brn number:1755921

pubchem number:24865258

physical property data

1. character: undetermined

2. density (g/ml,20℃):0.801

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

4. melting point (ºc)：：undetermined

5. boiling point (ºc,normal pressure): undetermined

6. boiling point (ºc,kpa): undetermined

7. refractive index:1.444

8. flashpoint (ºc): undetermined

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 upper limit (%,v/v): undetermined

18. lower explosion limit (%,v/v): undetermined

19. solubility: undetermined

toxicological data

none

ecological data

none

molecular structure data

5. molecular property data:

1. molar refractive index: 89.16

2. molar volume (m³/mol）：332.9

3. isotonic specific volume (90.2k):773.9

4. surface tension (dyne/cm):29.2

5. polarizability（10^-24cm³):35.34

compute chemical data

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

2. number of hydrogen bond donors: 0

3. number of hydrogen bond acceptors: 1

4. number of rotatable chemical bonds: 15

5. number of tautomers: none

6. topological molecule polar surface area 3.2

7. number of heavy atoms: 19

8. surface charge: 0

9. complexity: 154

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

storage method

none

synthesis method

none

purpose

none

m-alt: auto; mso-list: l0 level2 lfo1; tab-stops: list 36.0pt” align=left>4. surface tension (dyne/cm）：29.2

5. polarizability（10^-24cm³):35.34

compute chemical data

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

2. number of hydrogen bond donors: 0

3. number of hydrogen bond acceptors: 1

4. number of rotatable chemical bonds: 15

5. number of tautomers: none

6. topological molecule polar surface area 3.2

7. number of heavy atoms: 19

8. surface charge: 0

9. complexity: 154

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

storage method

none

synthesis method

none

purpose

none