5-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy-2-(4-methylphenyl)sulfonyloxybenzenesulfonic acid (CHEM330933)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-30 17:01:02 UTC | ||||||||
| Update Date | 2026-08-30 17:01:02 UTC | ||||||||
| Accession Number | CHEM330933 | ||||||||
| Identification | |||||||||
| Common Name | 5-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy-2-(4-methylphenyl)sulfonyloxybenzenesulfonic acid | ||||||||
| Class | Small Molecule | ||||||||
| Description | 5-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy-2-(4-methylphenyl)sulfonyloxybenzenesulfonic acid is a chemical compound with the formula C23H21ClO9S2. With an average molecular weight of 541.00 g/mol, 5-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy-2-(4-methylphenyl)sulfonyloxybenzenesulfonic acid is a heavy molecule. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C23H21ClO9S2 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 540.032 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 5-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy-2-(4-methylphenyl)sulfonyloxybenzenesulfonic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)OC(=O)C(C)(C)OC3=CC=C(C=C3)Cl)S(=O)(=O)O | ||||||||
| InChI Identifier | InChI=1S/C23H21ClO9S2/c1-15-4-11-19(12-5-15)35(29,30)33-20-13-10-18(14-21(20)34(26,27)28)31-22(25)23(2,3)32-17-8-6-16(24)7-9-17/h4-14H,1-3H3,(H,26,27,28) | ||||||||
| InChI Key | CVQHNHBXOJZLKA-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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| Spectra |
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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 | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
