bis(p-nitrophenyl)disulfide

structural formula

• numbering system
• physical property data
• toxicological data
• ecological data
• molecular structure data
• computing chemical data
• more
  • properties and stability
  • storage method
  • synthesis method
  • purpose

numbering system

cas number:100-32-3

mdl number:mfcd00003573

einecs number:202-840-5

rtecs number:jo1550000

brn number:none

pubchem id:none

physical property data

none yet

toxicological data

1. other multiple dose toxicity: rat oral tdlo: 1078mg/kg/7d-i; 2. mutagenicity: mutant microbial test: bacteria – salmonella typhimurium, 50μg/plate;

ecological data

none yet

molecular structure data

1. molar refractive index: 79.55

2. molar volume (cm³/mol): 201.7

3. isotonic specific volume (90.2k ): 596.3

4. surface tension (dyne/cm): 76.3

5. dielectric constant:

6. dipole moment (10^-24cm³):

7. polarizability: 31.53

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): 3.7

2. number of hydrogen bond donors: 0

3. number of hydrogen bond acceptors: 6

4. number of rotatable chemical bonds: 3

5. number of tautomers: none

6. topological molecule polar surface area 142

7. number of heavy atoms: 20

8. surface charge: 0

9. complexity: 308

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