2-(4-benzyl-5-sulfanylidene-1h-1,2,4-triazol-3-yl)acetic acid (CHEM154482)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-18 08:05:18 UTC | ||||||||
| Update Date | 2026-08-18 08:05:18 UTC | ||||||||
| Accession Number | CHEM154482 | ||||||||
| Identification | |||||||||
| Common Name | 2-(4-benzyl-5-sulfanylidene-1h-1,2,4-triazol-3-yl)acetic acid | ||||||||
| Class | Small Molecule | ||||||||
| Description | 2-(4-benzyl-5-sulfanylidene-1h-1,2,4-triazol-3-yl)acetic acid belongs to the benzene and substituted derivatives, a class of benzenoids within the organic compounds. This compound has the chemical formula C11H11N3O2S and an average molecular weight of 249.29 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C11H11N3O2S | ||||||||
| Average Molecular Mass | 249.290 g/mol | ||||||||
| Monoisotopic Mass | 249.057 g/mol | ||||||||
| CAS Registry Number | 170746-99-3 | ||||||||
| IUPAC Name | 2-(4-benzyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)acetic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | Not Available | ||||||||
| InChI Identifier | InChI=1S/C11H11N3O2S/c15-10(16)6-9-12-13-11(17)14(9)7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,13,17)(H,15,16) | ||||||||
| InChI Key | IWYFNJQFRWABIB-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 | |||||||||
| Not Available | |||||||||
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| Identifiers | Not Available | ||||||||
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| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
