Tribromoacetic Acid Tribromoacetic Acid
Structural formula
| Business number | 01KG |
|---|---|
| Molecular formula | C2HBr3O2 |
| Molecular weight | 296.74 |
| label |
tribromoacetic acid, Acetic Acid, Tribromo-, CBr3CO2H |
Numbering system
CAS number:75-96-7
MDL number:MFCD00004167
EINECS number:200-919-9
RTECS number:None
BRN number:1755150
PubChem number:24900230
Physical property data
1. Properties: colorless and shiny flaky crystals [1]
2. Melting point: 130~133[2]
3. Boiling point: 245 (decomposition) [3]
4. Octanol/water partition coefficient: 1.71[4]
5. Solubility: soluble in water, ethanol, ether, but insoluble in petroleum ether. [5]
Toxicological data
1. Acute toxicity No data available
2. Irritation No data available
Ecological data
1. Ecotoxicity No data available
2. Biodegradability No data available
3 .Non-biodegradability No information available
4. Other harmful effects[6] This substance is harmful to the environment and should be treated with special Pay attention to water pollution.
Molecular structure data
1. Molar refractive index: 36.04
2. Molar volume (cm3/mol): 95.7
3. Isotonic specific volume (90.2K ): 285.0
4. Surface tension (dyne/cm): 78.4
5. Polarizability (10-24cm3): 14.28
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): 2.2
2. Number of hydrogen bond donors: 1
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 37.3
7. Number of heavy atoms: 7
8. Surface charge: 0
9. Complexity: 83.4
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
1. Stability[7] Stable
2. Incompatible substances[8] Strong oxidants, strong alkalis
3. Conditions to avoid contact[9] Light
4. Polymerization hazard[10] No polymerization
5. Decomposition products[11] Bromide
Storage method
Storage Precautions[12] Store in a cool, ventilated warehouse. Keep away from fire and heat sources. The packaging is sealed. They should be stored separately from oxidants and alkalis, and avoid mixed storage. Equipped with corresponding products� and quantity of fire fighting equipment. Suitable materials should be available in the storage area to contain spills.
Synthesis method
None
Purpose
Used in organic synthesis. [13]
