5-Methyl-3-(1,1,3,3-tetramethylbutyl)pyrocatechol (CHEM066837)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-03 17:51:31 UTC | ||||||||
| Update Date | 2026-08-19 12:41:04 UTC | ||||||||
| Accession Number | CHEM066837 | ||||||||
| Identification | |||||||||
| Common Name | 5-Methyl-3-(1,1,3,3-tetramethylbutyl)pyrocatechol | ||||||||
| Class | Small Molecule | ||||||||
| Description | 5-Methyl-3-(1,1,3,3-tetramethylbutyl)pyrocatechol belongs to the phenylpropanes, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the chemical formula C15H24O2 and an average molecular weight of 236.35 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C15H24O2 | ||||||||
| Average Molecular Mass | 236.355 g/mol | ||||||||
| Monoisotopic Mass | 236.178 g/mol | ||||||||
| CAS Registry Number | 2213-68-5 | ||||||||
| IUPAC Name | 5-methyl-3-(2,4,4-trimethylpentan-2-yl)benzene-1,2-diol | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC1=CC(=C(O)C(O)=C1)C(C)(C)CC(C)(C)C | ||||||||
| InChI Identifier | InChI=1S/C15H24O2/c1-10-7-11(13(17)12(16)8-10)15(5,6)9-14(2,3)4/h7-8,16-17H,9H2,1-6H3 | ||||||||
| InChI Key | KEUANYXDVWBCRM-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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| 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 | ||||||||
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| Identifiers | Not Available | ||||||||
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| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
