structural formula
| business number | 03kz |
|---|---|
| molecular formula | c6h5clnnao2s |
| molecular weight | 213.62 |
| label |
benzenesulfonyl chloride sodium salt, n-chlorobenzenesulfonamide sodium salt, aromatic compounds |
numbering system
cas number:127-52-6
mdl number:mfcd00149552
einecs number:204-847-9
rtecs number:da9300000
brn number:3599287
pubchem number:24853921
physical property data
none
toxicological data
none
ecological data
none
molecular structure data
none
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp):
2. number of hydrogen bond donors: 1
3. number of hydrogen bond acceptors: 3
4. number of rotatable chemical bonds: 2
5. number of tautomers:
6. topological molecular polar surface area (tpsa):46.2
7. number of heavy atoms: 12
8. surface charge: 0
9. complexity: 203
10. number of isotope atoms: 0
11. determine the number of atomic stereocenters: 0
12. the number of uncertain atomic stereocenters: 0
13. determine the number of stereocenters of chemical bonds: 0
14. uncertain number of chemical bond stereocenters: 0
15. number of covalent bond units: 2
properties and stability
none
storage method
none
synthesis method
none
purpose
none
-us style=”font-size: 9pt; font-family: 宋体; mso-bidi-font-family: 宋体”>11, determine the number of atomic stereocenters: 0
12. the number of uncertain atomic stereocenters: 0
13. determine the number of stereocenters of chemical bonds: 0
14. uncertain number of chemical bond stereocenters: 0
15. number of covalent bond units: 2
properties and stability
none
storage method
none
synthesis method
none
purpose
none
