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: widow-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
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