structural formula
business number | 05v7 |
---|---|
molecular formula | c7h4br4o |
molecular weight | 423.72 |
label |
2,3,4,5-tetrabromo-6-methyl-pheno, aromatic compounds |
numbering system
cas number:576-55-6
mdl number:mfcd00002148
einecs number:209-403-8
rtecs number:gp3135000
brn number:none
pubchem number:24856732
physical property data
1. physical property data
1. melting point (ºc): 209-213
toxicological data
none
ecological data
none
molecular structure data
5. molecular property data: 1. molar refractive index:63.72 2. molar volume (m3/mol):168.8 3. isotonic specific volume (90.2k):461.9 4. surface tension (dyne/cm):55.9 5. polarizability(10-24cm3):25.26 |
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): 4.7
2. number of hydrogen bond donors: 1
3. number of hydrogen bond acceptors: 1
4. number of rotatable chemical bonds: 0
5. number of tautomers: 3
6. topological molecule polar surface area 20.2
7. number of heavy atoms: 12
8. surface charge: 0
9. complexity: 166
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