2,4,6-trichlorophenoxyacetic acid
structural formula
| business number | 05v2 |
|---|---|
| molecular formula | c8h5cl3o3 |
| molecular weight | 255.48 |
| label |
aurora 21967, aromatic compounds |
numbering system
cas number:575-89-3
mdl number:none
einecs number:209-394-0
rtecs number:aj8405000
brn number:none
pubchem id:none
physical property data
1. physical property data
1. melting point (ºc): 185
toxicological data
none yet
ecological data
none yet
molecular structure data
5. molecular property data:
1. molar refractive index: 53.81
2. molar volume (m3/mol）：160.4
3. isotonic specific volume (90.2k):433.1
4. surface tension (dyne/cm):53.1
5. polarizability（10-24cm3):21.33
compute chemical data
4. calculated chemical data:
1. hydrophobic parameter calculation reference value (xlogp) ：3.6
2. hydrogen bonding number of donors: 1
3. hydrogen bonding number of receptors: 3
4. rotatable number of chemical bonds: 3
5. topological molecules polar surface area (tpsa）：46.5
6. heavy atoms quantity: 14
7. surface charge ：0
8. complexity:200
9. isotope atomic number:0
10. determine the number of atomic stereocenters:0
11. uncertain number of atomic stereocenters:0
12. determine the number of stereocenters of chemical bonds:0
13. uncertain number of chemical bond stereocenters:0
14. number of covalent bond units: 1
properties and stability
none yet
storage method
none yet
synthesis method
none yet
purpose
none yet
