Phenol, 2,4-bis(1,1-dimethylethyl)-, sodium salt (CHEM099151)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-05 10:21:23 UTC | ||||||||
| Update Date | 2026-05-20 19:38:38 UTC | ||||||||
| Accession Number | CHEM099151 | ||||||||
| Identification | |||||||||
| Common Name | Phenol, 2,4-bis(1,1-dimethylethyl)-, sodium salt | ||||||||
| Class | Small Molecule | ||||||||
| Description | Phenol, 2,4-bis(1,1-dimethylethyl)-, sodium salt belongs to the phenylpropanes, a subclass of benzene and substituted derivatives within the organic compounds. It is classified under the benzenoids superclass. The compound has the formula C14H21NaO and an average molecular weight of 228.31 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type |
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| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C14H21NaO | ||||||||
| Average Molecular Mass | 228.311 g/mol | ||||||||
| Monoisotopic Mass | 228.149 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | Sodium 2,4-di-tert-butylphenolate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | [Na+].CC(C)(C)C1=CC=C([O-])C(=C1)C(C)(C)C | ||||||||
| InChI Identifier | InChI=1S/C14H22O.Na/c1-13(2,3)10-7-8-12(15)11(9-10)14(4,5)6;/h7-9,15H,1-6H3;/q;+1/p-1 | ||||||||
| InChI Key | ZDPVQLNNWLCTPU-UHFFFAOYSA-M | ||||||||
| 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 | ||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
