3-Hydroxy-2,4,6-tribromobenzoic acid
Synonym(s):3-Hydroxy-2,4,6-tribromobenzoic acid
- CAS NO.：14348-40-4
- Empirical Formula: C7H3Br3O3
- Molecular Weight: 374.81
- MDL number: MFCD00055557
- EINECS: 619-514-7
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-01-02 10:32:03
What is 3-Hydroxy-2,4,6-tribromobenzoic acid?
Description
TBHBA (2,4,6-Tribromo-3-hydroxybenzoic acid; 3-Hydroxy-2,4,6-tribromobenzoic acid) is produced by reacting with 4-aminoantipyrine (4-AA) or 3-methylbenzothiazole in the presence of hydrogen peroxide and peroxidase. Oxidative coupling reaction of methylone hydrazone (MBTH) to form highly stable dyes.
Chemical properties
White crystals
Properties of 3-Hydroxy-2,4,6-tribromobenzoic acid
| Melting point: | 145-148 °C (lit.) |
| Boiling point: | 121°C (rough estimate) |
| Density | 2.3705 (rough estimate) |
| refractive index | 1.5438 (estimate) |
| storage temp. | Keep in dark place,Inert atmosphere,Room temperature |
| form | Crystals |
| pka | 1.15±0.10(Predicted) |
| color | White |
| Water Solubility | insoluble |
| BRN | 2844497 |
| InChI | InChI=1S/C7H3Br3O3/c8-2-1-3(9)6(11)5(10)4(2)7(12)13/h1,11H,(H,12,13) |
| CAS DataBase Reference | 14348-40-4(CAS DataBase Reference) |
Safety information for 3-Hydroxy-2,4,6-tribromobenzoic acid
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 3-Hydroxy-2,4,6-tribromobenzoic acid
| InChIKey | YDBHVMTTYXWHLI-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1=C(Br)C=C(Br)C(O)=C1Br |
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