Structural formula
Business number | 03T2 |
---|---|
Molecular formula | C11H12Cl4N2O3 |
Molecular weight | 362.04 |
label |
3-(4-Chlorophenyl)-1,1-dimethyluroniumtrichloroacetate, aromatic compounds |
Numbering system
CAS number:140-41-0
MDL number:MFCD00137365
EINECS number:None
RTECS number:None
BRN number:None
PubChem ID:None
Physical property data
None yet
Toxicological data
2. Toxicological data:
1, acute toxicity: rat oral LD50: 2300 mg/kg;
Rabbit skinLD50: 1 mg/kg
Ecological data
3. Ecological data:
1, other harmful effects: This substance may be harmful to the environment, special attention should be paid to water bodies.
Molecular structure data
None yet
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Hydrogen bondingNumber of donors: 2
3. Number of hydrogen bond acceptors: 3
4. Number of rotatable chemical bonds: 1
5. Tautomers Number: 2
6. Topological molecule polar surface area 69.6
7. Number of heavy atoms: 20
8. Surface charge: 0
9. Complexity: 260
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 0
12. Uncertain Number of atomic stereocenters: 0
13. Determined number of stereocenters of chemical bonds: 0
14. Uncertain number of stereocenters of chemical bonds: 0
15 .Number of covalent bond units: 2
Properties and stability
Stable under normal temperature and pressure.
Storage method
Sealed in Store in a dry and cool place.
Synthesis method
None yet
Purpose
None yet