structural formula
| business number | 03q9 |
|---|---|
| molecular formula | c26h20n2o2s2 |
| molecular weight | 456.59 |
| label |
n,n’-(dithiobis-2,1-phenylene)dibenzamide, 2,2′-dibenzoylamidodiphenyldisulfide, peptone f403, disulfide(o-phenylaline benzene), 2,2′-dithiobisbenzanilide, aromatic compounds |
numbering system
cas number:135-57-9
mdl number:mfcd00043806
einecs number:205-201-9
rtecs number:cv8700000
brn number:none
pubchem id:none
physical property data
none
toxicological data
skin/eye irritation data
rabbit eye contact :500mg/24hmild reaction
acute toxicity data ：
rat sutra 口ld50:>4mg/kg
ecological data
none
molecular structure data
molecular property data:
1、 molar refractive index：133.70
2、 molar volume（m3/mol): 337.4
3、 isotonic specific volume（90.2k）：973.3
4、 surface tension（3.0 dyne/cm span>):69.2
5、 polarizability（ 0.5 10-24cm3): 53.00
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): 5.7
2. number of hydrogen bond donors: 2
3. number of hydrogen bond acceptors: 4
4. number of rotatable chemical bonds: 7
5. number of tautomers: 3
6. topological molecule polar surface area 109
7. number of heavy atoms: 32
8. surface charge: 0
9. complexity: 553
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
storage method
none
synthesis method
none
purpose
none
ottom-alt: auto; mso-pagination: wi-orphan” align=left>5 , span>polarizability（0.5 10-24cm3 ): 53.00
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): 5.7
2. number of hydrogen bond donors: 2
3. number of hydrogen bond acceptors: 4
4. number of rotatable chemical bonds: 7
5. number of tautomers: 3
6. topological molecule polar surface area 109
7. number of heavy atoms: 32
8. surface charge: 0
9. complexity: 553
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
storage method
none
synthesis method
none
purpose
none
