phenoldisulfonic acid phenoldisulfonic acid solution
structural formula
| business number | 02bg |
|---|---|
| molecular formula | c6h6o7s2 |
| molecular weight | 254.24 |
| label |
4-hydroxy-1,3-benzenedisulfonic acid, 4-hydroxybenzenedisulfonicacid |
numbering system
cas number:96-77-5
mdl number:none
einecs number:202-533-6
rtecs number:none
brn number:none
pubchem id:none
physical property data
none
toxicological data
none
ecological data
none
molecular structure data
1. molar refractive index: 48.98
2. molar volume (cm3/mol): 133.4
3. isotonic specific volume (90.2k ): 410.3
4. surface tension (dyne/cm): 89.5
5. polarizability (10-24cm3): 19.41
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): none
2. number of hydrogen bond donors: 3
3. number of hydrogen bond acceptors: 7
4. number of rotatable chemical bonds: 2
5. number of tautomers: 3
6. topological molecule polar surface area 146
7. number of heavy atoms: 15
8. surface charge: 0
9. complexity: 411
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
