(5-chloro-7-iodoquinolin-8-yl) 2-acetamidobenzenesulfonate (CHEM300797)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-28 22:26:35 UTC | ||||||||
| Update Date | 2026-08-28 22:26:35 UTC | ||||||||
| Accession Number | CHEM300797 | ||||||||
| Identification | |||||||||
| Common Name | (5-chloro-7-iodoquinolin-8-yl) 2-acetamidobenzenesulfonate | ||||||||
| Class | Small Molecule | ||||||||
| Description | (5-chloro-7-iodoquinolin-8-yl) 2-acetamidobenzenesulfonate belongs to the benzenesulfonic acids and derivatives, a subclass of benzene and substituted derivatives within the organic compounds. It has the chemical formula C17H12ClIN2O4S. With an average molecular weight of 502.70 g/mol, (5-chloro-7-iodoquinolin-8-yl) 2-acetamidobenzenesulfonate is a heavy molecule. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C17H12ClIN2O4S | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 501.925 g/mol | ||||||||
| CAS Registry Number | 63413-56-9 | ||||||||
| IUPAC Name | (5-chloro-7-iodoquinolin-8-yl) 2-acetamidobenzenesulfonate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC(=O)NC1=CC=CC=C1S(=O)(=O)OC2=C(C=C(C3=C2N=CC=C3)Cl)I | ||||||||
| InChI Identifier | InChI=1S/C17H12ClIN2O4S/c1-10(22)21-14-6-2-3-7-15(14)26(23,24)25-17-13(19)9-12(18)11-5-4-8-20-16(11)17/h2-9H,1H3,(H,21,22) | ||||||||
| InChI Key | JMTNKICQECJLNE-UHFFFAOYSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
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| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
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| Identifiers | Not Available | ||||||||
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| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
