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| Synonyms | TBPB | NSC11236 | Phenol, 4,4'-(4,5,6,7-tetrabromo-1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2,6-dibromo- | Q27288730 | o-Toluenesulfonic acid,4,5,6-tetrabromo-.alpha.,.alpha.-bis(3,5-dibromo-4-hydroxyphenyl)-.alpha.-hydroxy- | PHENOL, 4,4'-(4,5,6,7-T |
|---|---|
| Specifications & Purity | high-purity, ≥95%(HPLC) |
| Biochemical and Physiological Mechanisms | Tetrabromophenol Blue (TBPB) belongs to the group of sulfonephthalein acid-base indicators. It is employed in the potentiometric titration of the halogens with Hg2(NO3)2. In addition, it has been used as a dye indicator in urine dipstick test to detect pr |
| Storage Temp | Argon charged |
| Shipped In | Normal |
| Grade | high-purity |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Benzofurans |
| Subclass | Benzofuranones |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzofuranones |
| Alternative Parents | Phthalides Benzoxathioles O-bromophenols Bromobenzenes Organosulfonic acid esters Aryl bromides Oxacyclic compounds Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Benzofuranone - Phthalide - Benzoxathiole - 2-halophenol - 2-bromophenol - Bromobenzene - Phenol - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid ester - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Oxacycle - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as benzofuranones. These are organic compounds containing a benzene ring fused to a furanone. |
| External Descriptors | Not available |
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| Pubchem Sid | 488185525 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488185525 |
| IUPAC Name | 2,6-dibromo-4-[4,5,6,7-tetrabromo-3-(3,5-dibromo-4-hydroxyphenyl)-1,1-dioxo-2,1λ6-benzoxathiol-3-yl]phenol |
| INCHI | InChI=1S/C19H6Br8O5S/c20-7-1-5(2-8(21)16(7)28)19(6-3-9(22)17(29)10(23)4-6)11-12(24)13(25)14(26)15(27)18(11)33(30,31)32-19/h1-4,28-29H |
| InChIKey | QPMIVFWZGPTDPN-UHFFFAOYSA-N |
| Smiles | C1=C(C=C(C(=C1Br)O)Br)C2(C3=C(C(=C(C(=C3Br)Br)Br)Br)S(=O)(=O)O2)C4=CC(=C(C(=C4)Br)O)Br |
| Isomeric SMILES | C1=C(C=C(C(=C1Br)O)Br)C2(C3=C(C(=C(C(=C3Br)Br)Br)Br)S(=O)(=O)O2)C4=CC(=C(C(=C4)Br)O)Br |
| WGK Germany | 3 |
| PubChem CID | 78159 |
| Molecular Weight | 985.54 |
| Beilstein | 378438 |
| Reaxy-Rn | 378438 |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | May 23, 2025 | T100507 | |
| Certificate of Analysis | May 23, 2025 | T100507 | |
| Certificate of Analysis | Mar 04, 2025 | T100507 | |
| Certificate of Analysis | Nov 11, 2024 | T100507 | |
| Certificate of Analysis | Nov 11, 2024 | T100507 | |
| Certificate of Analysis | Nov 05, 2024 | T100507 | |
| Certificate of Analysis | Aug 15, 2023 | T100507 | |
| Certificate of Analysis | May 20, 2023 | T100507 | |
| Certificate of Analysis | Mar 15, 2023 | T100507 | |
| Certificate of Analysis | Mar 09, 2023 | T100507 | |
| Certificate of Analysis | Jul 21, 2022 | T100507 | |
| Certificate of Analysis | Jun 04, 2022 | T100507 |
| Solubility | Soluble in water |
|---|---|
| Sensitivity | Moisture sensitive |
| Melt Point(°C) | 204°C |
| Molecular Weight | 985.500 g/mol |
| XLogP3 | 8.800 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 985.332 Da |
| Monoisotopic Mass | 977.34 Da |
| Topological Polar Surface Area | 92.200 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 791.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
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