2,6-di-tert-butyl-4-(dimethylaminomethyl)phenol

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:88-27-7

mdl number:mfcd00026283

einecs number:201-816-1

rtecs number:go7887000

brn number:884076

pubchem number:24865853

physical property data

1. character: white or light yellow crystalline powder.

2. density ( g/ml,25/4℃) ：0.97

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

4. melting point ( ºc): 94

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

6. boiling point ( ºc,5.2kpa): undetermined

7. refractive index: undetermined

8. flashpoint (ºc): 138℃

9. specific optical rotation (º): undetermined

10. autoignition point or ignition temperature (ºc): not ok

11. vapor pressure (kpa,25ºc): undetermined

12. saturation vapor pressure (kpa,60ºc): undetermined

13.、 number of tautomers: 2

6 , topological molecular polar surface area (tpsa): 23.5

7 , number of heavy atoms: 19

8 , surface charge: 0

9 , complexity: 261

10 , isotope atomic number: 0

11 , determine the number of atomic stereocenters: 0

12 , uncertain number of atomic stereocenters: 0

13 , determine the number of stereocenters of chemical bonds: 0

14 , uncertain number of chemical bond stereocenters: 0

15 , number of covalent bond units: 1

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): 4.7

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: 2

6. topological molecule polar surface area 23.5

7. number of heavy atoms: 19

8. surface charge: 0

9. complexity: 261

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

this product should be sealed and stored in a cool, dry place.

synthesis method

none yet

purpose

antioxidants for rubber, synthetic resins, gasoline and oils.

font-kerning: 0pt; mso-bidi-font-family: arial”>uncertain number of stereocenters: 0

13 , determine the number of stereocenters of chemical bonds: 0

14 , uncertain number of chemical bond stereocenters: 0

15 , number of covalent bond units: 1

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): 4.7

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: 2

6. topological molecule polar surface area 23.5

7. number of heavy atoms: 19

8. surface charge: 0

9. complexity: 261

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

this product should be sealed and stored in a cool, dry place.

synthesis method

none yet

purpose

antioxidants for rubber, synthetic resins, gasoline and oils.