Determine the necessary mass, volume, or concentration for preparing a solution.
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≥95%(T) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Conservar a 2-8°C,Protegido de la luz Ships Hielo húmedo 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Este producto se suministra tal y como lo especifica la farmacopea emisora. Toda la información proporcionada en apoyo de este producto, incluyendo SDS y cualquier folleto de información del producto se han desarrollado y publicado bajo la autoridad de la Farmacopea emisora. Para más información y apoyo, por favor visite el sitio web de la Farmacopea emisora
| Pubchem Sid | 504750815 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504750815 |
| Sonrisas canónicas | C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)C(=O)O |
| IUPAC Name | 2-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamoyl]benzoic acid |
| InChIKey | PBMSWVPMRUJMPE-UHFFFAOYSA-N |
| INCHI | 1S/C17H13N3O5S2/c21-15(13-3-1-2-4-14(13)16(22)23)19-11-5-7-12(8-6-11)27(24,25)20-17-18-9-10-26-17/h1-10H,(H,18,20)(H,19,21)(H,22,23) |
| Isómeros SMILES | C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)C(=O)O |
| RTECS | TH8575000 |
| PubChem CID | 4806 |
| Peso molecular | 403.43 |
| Reaxy-Rn | 359901 |
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 | Benzenoids |
| Clase | Benzene and substituted derivatives |
| Subclass | Anilides |
| Intermediate Tree Nodes | Aromatic anilides |
| Direct Parent | Benzanilides |
| Alternative Parents | Benzenesulfonamides Benzamides Benzenesulfonyl compounds Benzoic acids Benzoyl derivatives Organosulfonamides Thiazoles Aminosulfonyl compounds Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organooxygen compounds Organopnictogen compounds |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Benzanilide - Benzenesulfonamide - Benzamide - Benzoic acid or derivatives - Benzoic acid - Benzenesulfonyl group - Benzoyl - Organosulfonic acid amide - Azole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Thiazole - Aminosulfonyl compound - Secondary carboxylic acid amide - Carboxamide group - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as benzanilides. These are aromatic compounds containing an anilide group in which the carboxamide group is substituted with a benzene ring. They have the general structure RNC(=O)R', where R,R'= benzene. |
| External Descriptors | sulfonamide - 1,3-thiazole - dicarboxylic acid monoamide |
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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 | Nov 12, 2024 | P160593 | |
| Certificate of Analysis | Nov 12, 2024 | P160593 | |
| Certificate of Analysis | Nov 12, 2024 | P160593 | |
| Certificate of Analysis | Oct 11, 2022 | P160593 | |
| Certificate of Analysis | Oct 11, 2022 | P160593 | |
| Certificate of Analysis | Oct 11, 2022 | P160593 | |
| Certificate of Analysis | Oct 11, 2022 | P160593 |
| Sensibilidad | Light sensitive |
|---|---|
| Punto de fusión (°C) | 240 °C |
| Peso molecular | 403.400 g/mol |
| XLogP3 | 1.100 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 403.03 Da |
| Monoisotopic Mass | 403.03 Da |
| Topological Polar Surface Area | 162.000 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 643.000 |
| 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 |