3,5-di-tert-butyl-4-hydroxybenzyl alcohol

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:88-26-6

mdl number:mfcd00017254

einecs number:201-815-6

rtecs number:do0750000

brn number:2052291

pubchem number:24868276

physical property data

none yet

toxicological data

none yet

ecological data

none yet

molecular structure data

1. molar refractive index: 71.36

2. molar volume (cm³/mol): 235.0

3. isotonic specific volume (90.2k ): 571.9

4. surface tension (dyne/cm): 35.0

5. polarizability (10-24cm3): 28.28

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): 4

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: 2

6. topological molecule polar surface area 40.5

7. number of heavy atoms: 17

8. surface charge: 0

9. complexity: 223

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