Determine the necessary mass, volume, or concentration for preparing a solution.
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| SKU | Size | Availability |
Price | Qty |
|---|---|---|---|---|
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D167718-50mg
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50mg |
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
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$10.90
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D167718-250mg
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250mg |
3
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$39.90
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D167718-1g
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1g |
3
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$77.90
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D167718-5g
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5g |
4
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$234.90
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D167718-25g
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25g |
2
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$1,055.90
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| Synonyms | A810422 | DS-15276 | FT-0637350 | 2-(((1R,2R,3aS,9aS)-2-hydroxy-1-((S)-3-hydroxyoctyl)-2,3,3a,4,9,9a-hexahydro-1H-cyclopenta[b]naphthalen-5-yl)oxy)acetic acid | AS-42049 | NSC263475 | NSC-263475 | 4-(aminomethyl)benzene-1,2-diol;hydrobromide | 3,4-Dihydro |
|---|---|
| Specifications & Purity | ≥97% |
| Storage Temp | Room temperature |
| Shipped In | Normal |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Phenols |
| Subclass | Benzenediols |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Catechols |
| Alternative Parents | Phenylmethylamines Benzylamines Aralkylamines 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Organooxygen compounds Monoalkylamines Hydrocarbon derivatives Hydrobromides |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Benzylamine - Catechol - Phenylmethylamine - Aralkylamine - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Monocyclic benzene moiety - Organic oxygen compound - Hydrocarbon derivative - Hydrobromide - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Amine - Organic nitrogen compound - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as catechols. These are compounds containing a 1,2-benzenediol moiety. |
| External Descriptors | Not available |
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| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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| Pubchem Sid | 488198411 |
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| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488198411 |
| IUPAC Name | 4-(aminomethyl)benzene-1,2-diol;hydrobromide |
| INCHI | InChI=1S/C7H9NO2.BrH/c8-4-5-1-2-6(9)7(10)3-5;/h1-3,9-10H,4,8H2;1H |
| InChIKey | BVFZTXFCZAXSHN-UHFFFAOYSA-N |
| Smiles | C1=CC(=C(C=C1CN)O)O.Br |
| Isomeric SMILES | C1=CC(=C(C=C1CN)O)O.Br |
| WGK Germany | 3 |
| Molecular Weight | 220.06 |
| Beilstein | 4002650 |
| Reaxy-Rn | 4002646 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4002646&ln= |
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 | Mar 04, 2025 | D167718 | |
| Certificate of Analysis | Mar 04, 2025 | D167718 | |
| Certificate of Analysis | Mar 04, 2025 | D167718 | |
| Certificate of Analysis | Mar 04, 2025 | D167718 | |
| Certificate of Analysis | Jan 10, 2024 | D167718 | |
| Certificate of Analysis | Jan 14, 2022 | D167718 | |
| Certificate of Analysis | Jan 14, 2022 | D167718 | |
| Certificate of Analysis | Jan 14, 2022 | D167718 | |
| Certificate of Analysis | Jan 14, 2022 | D167718 |
| Molecular Weight | 220.060 g/mol |
|---|---|
| XLogP3 | |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 218.989 Da |
| Monoisotopic Mass | 218.989 Da |
| Topological Polar Surface Area | 66.500 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 108.000 |
| 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 | 2 |
| 1. Qing Han, Xiaoxiao Wu, Yi Cao, Hua Zhang, Yuqin Zhao, Xuejun Kang, Huaiyuan Zhu. (2021) Selective Separation and Analysis of Catecholamines in Urine Based on Magnetic Solid Phase Extraction by Mercaptophenylboronic Acid Functionalized Fe3O4-NH2@Au Magnetic Nanoparticles Coupled with HPLC. Separations, 8 (11): (196). |