
structural formula
| business number | 01bf |
|---|---|
| molecular formula | c21h22n2o2·1/2h2so4 |
| molecular weight | 383.45 |
| label |
strychnine hemisulfate; strychnine hemisulfate, optical dividing agent |
numbering system
cas number:60-41-3
mdl number:mfcd00068328
einecs number:200-477-7
rtecs number:wl2550000
brn number:none
pubchem id:none
physical property data
none yet
toxicological data
none yet
ecological data
none yet
molecular structure data
none yet
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp):
2. number of hydrogen bond donors: 2
3. number of hydrogen bond acceptors: 10
4. number of rotatable chemical bonds: 0
5. number of tautomers:
6. topological molecular polar surface area (tpsa):140
7. number of heavy atoms: 55
8. surface charge: 0
9. complexity: 771
10. number of isotope atoms: 0
11. determine the number of atomic stereocenters: 12
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: 3
properties and stability
none yet
storage method
none yet
synthesis method
none yet
purpose
none yet
mso-bidi-font-family: 宋体”>11. determine the number of atomic stereocenters: 12
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: 3
properties and stability
none yet
storage method
none yet
synthesis method
none yet
purpose
none yet

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