2,3,5,6-Tetrachloronitrobenzene
Structural formula
| Business number | 038Z |
|---|---|
| Molecular formula | Cl4C6HNO2 |
| Molecular weight | 260.89 |
| label |
Folosan,Fusarex,Myfusan,Teknazen,Napotate, fragrance, fungicides, pesticides |
Numbering system
CAS number:117-18-0
MDL number:MFCD00007066
EINECS number:204-178-2
RTECS number:DC0175000
BRN number:1973805
PubChem number:24900478
Physical property data
1. Characteristics: Off-white powder.
2. Density (g/mL,25℃） ：1.744
3. Relative vapor density (g/mL,Air=1 ): Undetermined
4. Melting point (ºC): 98～101
5. Boiling point (ºC,normal pressure):304
6. Boiling point (ºC, KPa): Undetermined
7. Refractive index: Undetermined
8. Flashpoint (ºC): Undetermined
9. Specific optical rotation (º): Undetermined
10. Autoignition point or ignition temperature (ºC): Undetermined
11. Vapor pressure (mmHg, ºC): Undetermined
12. Saturated vapor pressure (kPa, ºC): Undetermined
13. Heat of combustion (KJ/mol): Undetermined
14. Critical temperature (ºC): Undetermined
15. Critical pressure (KPa): Undetermined
16. Oil and water (octanol/Log value of the partition coefficient for water: undetermined
17. Molar volume (m3/mol):149.0
3、 Isotonic specific volume (90.2K) ：406.2
4, Surface Tension (dyne/cm):55.1
5、 Polarizability (10-24cm3):20.76
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 0
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 0
5. Number of tautomers: none
6. Topological molecule polar surface area 45.8
7. Number of heavy atoms: 13
8. Surface charge: 0
9. Complexity: 195
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
Stable at normal temperature and pressure, avoid contact withStrong oxidants, strong basesContact.
Storage method
Stored in a cool, ventilated warehouse. Keep away from fire and heat sources. Protect from direct sunlight. The packaging is sealed. They should be stored separately from oxidants and alkalis, and avoid mixed storage. Equipped with the appropriate variety and quantity of fire equipment. Suitable materials should be available in the storage area to contain spills.
Synthesis method
None
Purpose
Used as a pesticide.
style=”FONT-SIZE: 9pt; COLOR: #304e00; FONT-FAMILY: Arial; mso-font-kerning: 0pt”>20.76
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 0
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 0
5. Number of tautomers: none
6. Topological molecule polar surface area 45.8
7. Number of heavy atoms: 13
8. Surface charge: 0
9. Complexity: 195
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
Stable at normal temperature and pressure, avoid contact withStrong oxidants, strong basesContact.
Storage method
Stored in a cool, ventilated warehouse. Keep away from fire and heat sources. Protect from direct sunlight. The packaging is sealed. They should be stored separately from oxidants and alkalis, and avoid mixed storage. Equipped with the appropriate variety and quantity of fire equipment. Suitable materials should be available in the storage area to contain spills.
Synthesis method
None
Purpose
Used as a pesticide.