Structural formula
Business number | 01YP |
---|---|
Molecular formula | C6H2Cl4O2 |
Molecular weight | 247.89 |
label |
2,3,5,6-tetrachloro-1,4-benzenediol, 2,3,5,6-Tetrachloro-1,4-benzenediol |
Numbering system
CAS number:87-87-6
MDL number:MFCD00041748
EINECS number:201-779-1
RTECS number:MX7700000
BRN number:None
PubChem number:24897397
Physical property data
None yet
Toxicological data
None yet
Ecological data
None yet
Molecular structure data
1. Molar refractive index: 49.59
2. Molar volume (cm3/mol): 134.0
3. Isotonic specific volume (90.2K ): 380.7
4. Surface tension (dyne/cm): 65.0
5. Polarizability (10-24cm3): 19.66
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 2
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 0
5. Number of tautomers: 3
6. Topological molecule polar surface area 40.5
7. Number of heavy atoms: 12
8. Surface charge: 0
9. Complexity: 134
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 yet
Storage method
None yet
Synthesis method
None yet
Purpose
None yet