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| | 2,4-Di-tert-butylphenol Basic information |
| Product Name: | 2,4-Di-tert-butylphenol | | Synonyms: | 2,4-bis(1,1-dimethylethyl)-pheno;2,4-di(1,1-dimethylethyl)-pheno;2,4-di-tert-butyl-pheno;2,4-tert-butylphenol;2,4-DI-TERT-BUTYLPHENOL;2,4-DITERTIARY BUTYL PHENOL;2,4-Di-#ntert.-butylphenol;2,4-DI-TERT-BUTYLPHENOL, ANTIOXIDANT | | CAS: | 96-76-4 | | MF: | C14H22O | | MW: | 206.32 | | EINECS: | 202-532-0 | | Product Categories: | Heterocycles;Bioactive Small Molecules;Building Blocks;C9 to C20+;Cell Biology;Chemical Synthesis;D-DIF;Organic Building Blocks;Oxygen Compounds;Organic Building Blocks;Oxygen Compounds;Phenols;Industrial/Fine Chemicals;Organics;96-76-4;VX:15169101773 | | Mol File: | 96-76-4.mol |  |
| | 2,4-Di-tert-butylphenol Chemical Properties |
| Melting point | 53-56 °C(lit.) | | Boiling point | 265 °C(lit.) | | density | 0.887 | | vapor pressure | 1 mm Hg ( 84.5 °C) | | refractive index | 1.5080 | | Fp | 239 °F | | storage temp. | Store below +30°C. | | solubility | water: soluble0.033g/L at 25°C | | form | Crystalline Solid | | pka | 11.56±0.18(Predicted) | | color | White to yellow | | PH | 4.5 (H2O, 20℃)(saturated aqueous solution) | | Water Solubility | practically insoluble | | BRN | 1910383 | | Stability: | Stable. Combustible. Incompatible with acid chlorides, oxidizing agents, acid anhydrides, copper, copper alloys, bases, brass. | | InChI | 1S/C14H22O/c1-13(2,3)10-7-8-12(15)11(9-10)14(4,5)6/h7-9,15H,1-6H3 | | InChIKey | ICKWICRCANNIBI-UHFFFAOYSA-N | | SMILES | CC(C)(C)c1ccc(O)c(c1)C(C)(C)C | | LogP | 4.8 at 23℃ | | CAS DataBase Reference | 96-76-4(CAS DataBase Reference) | | NIST Chemistry Reference | Phenol, 2,4-bis(1,1-dimethylethyl)-(96-76-4) | | EPA Substance Registry System | 2,4-Di-tert-butylphenol (96-76-4) |
| | 2,4-Di-tert-butylphenol Usage And Synthesis |
| Chemical Properties | light yellow crystals | | Uses | A chemical constituent of volatile oils from Catunaregam spinosa fruits. | | Uses | Phenolic Phosphites, UV Stabilizer Intermediate | | Uses | 2,4-Di-tert-butylphenol is used to study its alkylation reaction with cinnamyl alcohol in the presence of Al-substituted disordered hexagonal molecular silica catalysts. It is a raw material for phosphite anti-oxidants. The antioxidants are primarily used in the manufacture of polyolefins. It is also used as an intermediate for the preparation of UV stabilizers and in manufacturing of pharmaceuticals and fragrances. | | Definition | ChEBI: 2,4-di-tert-butylphenol is a member of the class of phenols carrying two tert-butyl substituents at positions 2 and 4. It has a role as a bacterial metabolite, an antioxidant and a marine metabolite. It is an alkylbenzene and a member of phenols. | | Synthesis Reference(s) | Tetrahedron Letters, 33, p. 5555, 1992 DOI: 10.1016/S0040-4039(00)61144-9 | | General Description | 2,4-Di-tert-butylphenol is isolated from the dried body of Scolopendra and possess antioxidative activity. | | Flammability and Explosibility | Non flammable |
| | 2,4-Di-tert-butylphenol Preparation Products And Raw materials |
| Raw materials | Phenol-->Isobutylene | | Preparation Products | Antioxidant 168-->2-(2'-Hydroxy-3',5'-di-tert-butylphenyl)-5-chlorobenzotriazole-->Ultranox 626-->2,2'-Ethylidenebis(4,6-di-tert-butylphenol)-->Phenol, 2,4-bis(1,1-diMethylethyl)-5-nitro--->5-AMino-2,4-di-tert-butylphenol-->UV-320-->2-Benzyl-4,6-bis(tert-butyl)phenol-->Benzene, 2,4-bis(1,1-dimethylethyl)-1-[(trimethylsilyl)oxy]- |
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