Structural formula
Business number | 03KB |
---|---|
Molecular formula | C3H6O4SClNa |
Molecular weight | 196.59 |
label |
1-Chloro-2-hydroxy-propane-3-sulfonate sodium salt, Sodium 3-chloro-2-hydroxypropanesulfonate, aliphatic compounds |
Numbering system
CAS number:126-83-0
MDL number:MFCD00013378
EINECS number:None
RTECS number:None
BRN number:None
PubChem ID:None
Physical property data
1. Properties: white crystal powder
2. Melting point: 256℃
3. Acidity and alkalinity: pH (0.5%, H20) 4.5-7.0 (20℃)
Toxicological data
None
Ecological data
None
Molecular structure data
None
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: 4
4. Number of rotatable chemical bonds: 3
5. Number of tautomers: none
6. Topological molecule polar surface area 85.8
7. Number of heavy atoms: 10
8. Surface charge: 0
9. Complexity: 162
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 0
12. Uncertain number of atomic stereocenters: 1
13. Determine the number of chemical bond stereocenters: 0
14. Number of uncertain chemical bond stereocenters: 0
15. Number of covalent bond units: 2
Properties and stability
None
Storage method
Storage: Store at room temperature.
Synthesis method
None
Purpose
None