| Name | 1,4-Di-tert-butylbenzene |
| Synonyms | Dibutylbenzene P-DI-T-BUTYLBENZENE p-di-tert-butyl-benzen 1,4-ditert-butylbenzene 1,4-tert-dibutylbenzene P-DI-TERT-BUTYL BENZENE 1,4-Di-tert-butylbenzene Benzene, p-di-tert-butyl- benzene,1,4-di-tert-butyl- bis(1,1-dimethylethyl)benzene bis(1,1-dimethylethyl)-benzen 1,4-bis(1,1-dimethylethyl)-benzen |
| CAS | 1012-72-2 |
| EINECS | 213-790-9 |
| InChI | InChI=1/C14H22/c1-13(2,3)11-7-9-12(10-8-11)14(4,5)6/h7-10H,1-6H3 |
| Molecular Formula | C14H22 |
| Molar Mass | 190.32 |
| Density | 0.985 |
| Melting Point | 76-78°C(lit.) |
| Boling Point | 236°C(lit.) |
| Flash Point | 236°C |
| Water Solubility | Insoluble in water. Soluble in ethanol, benzene, carbon tetrachloride. |
| Vapor Presure | 0.0744mmHg at 25°C |
| Appearance | crystalline |
| Color | white |
| BRN | 1617000 |
| Storage Condition | Sealed in dry,Room Temperature |
| Refractive Index | 1.4955 (estimate) |
| MDL | MFCD00008836 |
| Physical and Chemical Properties | Melting point 76-79°C boiling point 236°C |
| Hazard Symbols | N - Dangerous for the environment![]() |
| Risk Codes | 50/53 - Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. |
| Safety Description | S22 - Do not breathe dust. S24/25 - Avoid contact with skin and eyes. S60 - This material and its container must be disposed of as hazardous waste. S61 - Avoid release to the environment. Refer to special instructions / safety data sheets. |
| UN IDs | UN 3077 9/PG 3 |
| WGK Germany | 3 |
| RTECS | CY8444000 |
| TSCA | Yes |
| HS Code | 29029090 |
| Hazard Class | 9 |
| Packing Group | III |
| NIST chemical information | Information provided by: webbook.nist.gov (external link) |
| EPA chemical information | Information provided by: ofmpub.epa.gov (external link) |
| use | organic synthesis intermediate. |
| production method | under rapid stirring, dry isobutylene is introduced into the mixture of benzene and sulfuric acid, the reaction is exothermic, the reaction temperature is about 15 ℃, the reaction is ventilated for 1-1.5h, the reaction is stirred for 1h, the sulfuric acid layer is separated, and a small amount of water is added to the oil layer to precipitate 1,4-di-tert-butylbenzene crystals. The oil layer is fractionated to obtain benzene, tert-butylbenzene and p-di-tert-butylbenzene. |