| Identification | Back Directory | [Name]
1-BROMO-2,4,6-TRI-TERT-BUTYLBENZENE | [CAS]
3975-77-7 | [Synonyms]
NSC 133894
2,4,6-Tri-tert-butylphenyl bromide
Bromo(1,3,5-tris-tert-butyl)benzene
Bromobenzene, 2,4,6-tri-tert-butyl-
1-BROMO-2,4,6-TRI-TERT-BUTYLBENZENE
1-BroMo-2,4,6-tri-tert-butylbenzene 97%
1-BROMO-2,4,6-TRI-TERT-BUTYLBENZENE 97+%
Benzene, 2-bromo-1,3,5-tris(1,1-dimethylethyl)- | [Molecular Formula]
C18H29Br | [MDL Number]
MFCD00191861 | [MOL File]
3975-77-7.mol | [Molecular Weight]
325.33 |
| Chemical Properties | Back Directory | [Melting point ]
168-173 °C (lit.) | [Boiling point ]
299.7±9.0 °C(Predicted) | [density ]
1.064±0.06 g/cm3(Predicted) | [storage temp. ]
Sealed in dry,Room Temperature | [Appearance]
White to off-white Solid | [BRN ]
1913257 | [InChI]
InChI=1S/C18H29Br/c1-16(2,3)12-10-13(17(4,5)6)15(19)14(11-12)18(7,8)9/h10-11H,1-9H3 | [InChIKey]
JOKZWHPYNRDCOA-UHFFFAOYSA-N | [SMILES]
C1(C(C)(C)C)=CC(C(C)(C)C)=CC(C(C)(C)C)=C1Br |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
36/37/38 | [Safety Statements ]
26-36 | [WGK Germany ]
3 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
| Hazard Information | Back Directory | [Uses]
1-Bromo-2,4,6-tri-tert-butylbenzene was used in the synthesis of bulky biarylphosphine ligand. This ligand was reported to participate in the Pd-catalyzed C-O cross-coupling of a wide range of aryl halides and phenols under milder conditions. It was used to investigate the effect on oligomerization of increased steric bulk in dimethylindium(III) chalcogenolates. It may be used to form α,α-dimethyl-β-phenyl hydrostyrene by reacting with phenylboronic acid. | [General Description]
1-Bromo-2,4,6-tri-tert-butylbenzene (2,4,6-tri-tert-butylbromobenzene) is a hindered aryl bromide. 1-Bromo-2,4,6-tri-tert-butylbenzene on reaction with phenylboronic acid yields α,α-dimethyl-β-phenyl hydrostyrene. |
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