2,5-dichlorobenzenesulfonic acid
structural formula
| business number | 01zf |
|---|---|
| molecular formula | c6h4cl2o3s |
| molecular weight | 227.07 |
| label |
none |
numbering system
cas number:88-42-6
mdl number:mfcd00035751
einecs number:201-829-2
rtecs number:none
brn number:none
pubchem id:none
physical property data
none yet
toxicological data
none yet
ecological data
none yet
molecular structure data
1. molar refractive index: 46.75
2. molar volume (cm3/mol): 136.1
3. isotonic specific volume (90.2k ): 374.5
4. surface tension (dyne/cm): 57.3
5. polarizability (10-24cm3): 18.53
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): none
2. number of hydrogen bond donors: 1
3. number of hydrogen bond acceptors: 3
4. number of rotatable chemical bonds: 1
5. number of tautomers: none
6. topological molecule polar surface area 62.8
7. number of heavy atoms: 12
8. surface charge: 0
9. complexity: 246
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