Structural formula
| Business number | 020G |
|---|---|
| Molecular formula | C7H6ClNO3 |
| Molecular weight | 187.58 |
| label |
4-Chloro-1-methoxy2-nitrobenzene, p-Chloro-o-nitroanisole, 4-Chloro-1-methoxy-2-nitrobenzene |
Numbering system
CAS number:89-21-4
MDL number:MFCD00024327
EINECS number:201-887-9
RTECS number:None
BRN number:None
PubChem ID:None
Physical property data
None
Toxicological data
None
Ecological data
None
Molecular structure data
None
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: 3
4. Number of rotatable chemical bonds: 1
5. Number of tautomers: none
6. Topological molecule polar surface area 55
7. Number of heavy atoms: 12
8. Surface charge: 0
9. Complexity: 171
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
