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
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Purpose
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