| Identification | More | [Name]
3,5-DI-TERT-BUTYL-O-BENZOQUINONE | [CAS]
3383-21-9 | [Synonyms]
3,5-DI-TERT-BUTYL-1,2-BENZOQUINONE
3,5-DI(TERT-BUTYL)BENZO-1,2-QUINONE
3,5-DI-TERT-BUTYL-O-BENZOQUINONE
3,5-di-t-Butyl-o-benzoquinone
3,5-Di-tert-butyl-o-quinone
3,5-di-tert-Butyl-ortho-benzoquinone
o-Benzoquinone, 3,5-di-tert-butyl-
Dibutylbenzoquinone
3,5-Cyclohexadiene-1,2-dione, 3,5-bis(1,1-dimethylethyl)-
3,5-DI-TERT-BUTYL-O-BENZOQUINONE 98+%
3,5-Di-tert-butylbenzoquinone, 98+%
3,5-Di-tert-butyl-1,2-benzenedione
3,5-Ditert-butyl-3,5-cyclohexadiene-1,2-dione
4,6-Ditert-butyl-3,5-cyclohexadiene-1,2-dione | [EINECS(EC#)]
222-189-0 | [Molecular Formula]
C14H20O2 | [MDL Number]
MFCD00001647 | [Molecular Weight]
220.31 | [MOL File]
3383-21-9.mol |
| Chemical Properties | Back Directory | [Appearance]
dark red crystals or powder | [Melting point ]
112-114 °C(lit.) | [Boiling point ]
321.25°C (rough estimate) | [density ]
1.0106 (rough estimate) | [refractive index ]
1.4970 (estimate) | [storage temp. ]
Sealed in dry,Room Temperature | [solubility ]
Chloroform (Sparingly), Methanol (Very Slightly) | [form ]
Solid | [color ]
Very Dark Green to Very Dark Brown | [Stability:]
Stable. Incompatible with reducing agents, strong oxidizing agents. | [BRN ]
2047944 | [InChI]
InChI=1S/C14H20O2/c1-13(2,3)9-7-10(14(4,5)6)12(16)11(15)8-9/h7-8H,1-6H3 | [InChIKey]
NOUZOVBGCDDMSX-UHFFFAOYSA-N | [SMILES]
C1(=O)C=C(C(C)(C)C)C=C(C(C)(C)C)C1=O | [CAS DataBase Reference]
3383-21-9(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes . | [WGK Germany ]
3
| [HS Code ]
29146990 | [Storage Class]
11 - Combustible Solids |
| Hazard Information | Back Directory | [Chemical Properties]
dark red crystals or powder | [Uses]
3,5-Di-tert-butyl-o-benzoquinone was used in the preparation of benzoxazoles derivative ligands. It was also used in the preparation of 1,4-benzodioxines via hetero Diels Alder reaction with acyclic dienes. | [Uses]
4,6-Di-tert-butyl-1,2-benzoquinone is a Ortho-Quinone derivative is know to possess a number of biological properties such as antitumoral, antimicrobacterial and anti-cardiovascular disease. | [Synthesis Reference(s)]
Tetrahedron, 44, p. 6397, 1988 DOI: 10.1016/S0040-4020(01)89827-6
Tetrahedron Letters, 23, p. 957, 1982 DOI: 10.1016/S0040-4039(00)86993-2 | [General Description]
Reactions of the phosphinidene-bridged complexes [Fe2(η5-C5H5)2(μ-PR)(μ-CO)(CO)2] (R = Cy, Ph) with 3,5-di-tert-butyl-o-benzoquinone has been reported. | [Purification Methods]
It can be recrystallised from MeOH or pet ether, and forms fine red plates or rhombs. [Flaig et al. Justus Liebigs Ann Chem 597 196 1955, IR: Ley & Müller Chem Ber 89 1402 1956, Beilstein 7 IV 2113.] |
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