Determine the necessary mass, volume, or concentration for preparing a solution.
≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 39 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Peroxidase substrate
| Pubchem Sid | 504756596 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504756596 |
| Sonrisas canónicas | COC(=O)C1=CC=CC=C1C2C3=C(C=C(C=C3)N)OC4=C2C=CC(=C4)N |
| IUPAC Name | methyl 2-(3,6-diamino-9H-xanthen-9-yl)benzoate |
| InChIKey | FNEZBBILNYNQGC-UHFFFAOYSA-N |
| INCHI | 1S/C21H18N2O3/c1-25-21(24)15-5-3-2-4-14(15)20-16-8-6-12(22)10-18(16)26-19-11-13(23)7-9-17(19)20/h2-11,20H,22-23H2,1H3 |
| Isómeros SMILES | COC(=O)C1=CC=CC=C1C2C3=C(C=C(C=C3)N)OC4=C2C=CC(=C4)N |
| WGK Alemania | 3 |
| Peso molecular | 346.38 |
| Reaxy-Rn | 5989965 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5989965&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Clase | Benzopyrans |
| Subclass | 1-benzopyrans |
| Intermediate Tree Nodes | Dibenzopyrans |
| Direct Parent | Xanthenes |
| Alternative Parents | Diarylethers Benzoic acid esters Benzoyl derivatives Methyl esters Amino acids and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Xanthene - Diaryl ether - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Monocyclic benzene moiety - Benzenoid - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Ether - Monocarboxylic acid or derivatives - Primary amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as xanthenes. These are polycyclic aromatic compounds containing a xanthene moiety, which consists of two benzene rings joined to each other by a pyran ring. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
| Certificate of Analysis | Jan 15, 2026 | D115501 | |
| Certificate of Analysis | Jan 15, 2026 | D115501 | |
| Certificate of Analysis | Jan 15, 2026 | D115501 | |
| Certificate of Analysis | Jan 15, 2026 | D115501 | |
| Certificate of Analysis | Dec 20, 2025 | D115501 | |
| Certificate of Analysis | Dec 20, 2025 | D115501 | |
| Certificate of Analysis | Dec 20, 2025 | D115501 | |
| Certificate of Analysis | Dec 20, 2025 | D115501 | |
| Certificate of Analysis | Dec 20, 2025 | D115501 | |
| Certificate of Analysis | Feb 05, 2025 | D115501 | |
| Certificate of Analysis | Feb 05, 2025 | D115501 | |
| Certificate of Analysis | Feb 05, 2025 | D115501 | |
| Certificate of Analysis | Feb 05, 2025 | D115501 | |
| Certificate of Analysis | Feb 05, 2025 | D115501 | |
| Certificate of Analysis | Feb 05, 2025 | D115501 | |
| Certificate of Analysis | Feb 05, 2025 | D115501 | |
| Certificate of Analysis | Feb 05, 2025 | D115501 | |
| Certificate of Analysis | May 06, 2024 | D115501 | |
| Certificate of Analysis | May 06, 2024 | D115501 | |
| Certificate of Analysis | May 06, 2024 | D115501 | |
| Certificate of Analysis | Aug 11, 2023 | D115501 | |
| Certificate of Analysis | Aug 11, 2023 | D115501 | |
| Certificate of Analysis | Aug 11, 2023 | D115501 | |
| Certificate of Analysis | Aug 11, 2023 | D115501 | |
| Certificate of Analysis | Aug 11, 2023 | D115501 | |
| Certificate of Analysis | Aug 11, 2023 | D115501 | |
| Certificate of Analysis | Aug 11, 2023 | D115501 | |
| Certificate of Analysis | Aug 11, 2023 | D115501 | |
| Certificate of Analysis | Aug 11, 2023 | D115501 | |
| Certificate of Analysis | Jan 29, 2023 | D115501 | |
| Certificate of Analysis | Jan 29, 2023 | D115501 | |
| Certificate of Analysis | Jan 29, 2023 | D115501 |
| Solubilidad | DMSO: >5 mg/mL |
|---|---|
| Sensibilidad | Light sensitive |
| Peso molecular | 346.400 g/mol |
| XLogP3 | 3.400 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 346.132 Da |
| Monoisotopic Mass | 346.132 Da |
| Topological Polar Surface Area | 87.600 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 487.000 |
| 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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