2-Bromo-1,3,5-tri-tert-butylbenzene

Base Information

Chemical Name:2-Bromo-1,3,5-tri-tert-butylbenzene
CAS No.:3975-77-7
Molecular Formula:C18H29 Br
Molecular Weight:325.332
Hs Code.:2903999090
European Community (EC) Number:627-406-6
NSC Number:133894
DSSTox Substance ID:DTXSID20192835
Nikkaji Number:J46.290J
Wikidata:Q63409116
Mol file:3975-77-7.mol

Synonyms:2-Bromo-1,3,5-tri-tert-butylbenzene;3975-77-7;2,4,6-Tri-tert-butylbromobenzene;1-Bromo-2,4,6-tri-tert-butylbenzene;2-bromo-1,3,5-tritert-butylbenzene;2,4,6-Tri-t-butyl-1-bromobenzene;MFCD00191861;2-bromo-1,3,5-tri-tert-butyl-benzene;NSC133894;Maybridge1_002617;DivK1c_001369;SCHEMBL198146;Benzene, 2-bromo-1,3,5-tris(1,1-dimethylethyl)-;HMS548O21;DTXSID20192835;JOKZWHPYNRDCOA-UHFFFAOYSA-N;1-Brom-2,4,6-tri-tert-butylbenzol;AKOS002669420;Bromobenzene, 2,4,6-tri-tert-butyl-;CS-W005543;NSC 133894;NSC-133894;CDS1_000329;AS-18339;SY110558;FT-0770312;1-Bromo-2,4,6-tri-tert-butylbenzene, 97%;(4,6-DIFLUORO-PYRIDIN-2-YL)-HYDRAZINE;A873570;Q63409116;InChI=1/C18H29Br/c1-16(2,3)12-10-13(17(4,5)6)15(19)14(11-12)18(7,8)9/h10-11H,1-9H

Suppliers and Price of 2-Bromo-1,3,5-tri-tert-butylbenzene

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
2-Bromo-1,3,5-tri-tert-butylbenzene
100mg
$ 75.00

Sigma-Aldrich
1-Bromo-2,4,6-tri-tert-butylbenzene 97%
1g
$ 105.00

Sigma-Aldrich
1-Bromo-2,4,6-tri-tert-butylbenzene 97%
5g
$ 360.00

Matrix Scientific
2-Bromo-1,3,5-tri-tert-butylbenzene 95+%
1g
$ 246.00

Matrix Scientific
2-Bromo-1,3,5-tri-tert-butylbenzene 95+%
5g
$ 656.00

Matrix Scientific
2-Bromo-1,3,5-tri-tert-butylbenzene 95+%
10g
$ 994.00

Crysdot
2-Bromo-1,3,5-tri-tert-butylbenzene 97%
100g
$ 1307.00

Crysdot
2-Bromo-1,3,5-tri-tert-butylbenzene 97%
10g
$ 257.00

Crysdot
2-Bromo-1,3,5-tri-tert-butylbenzene 97%
25g
$ 515.00

Chemenu
2-Bromo-1,3,5-tri-tert-butylbenzene 95+%
10g
$ 243.00

Total 29 raw suppliers

Chemical Property of 2-Bromo-1,3,5-tri-tert-butylbenzene

Chemical Property:

Vapor Pressure:0.00209mmHg at 25°C
Melting Point:168-173 °C(lit.)
Boiling Point:299.7°Cat760mmHg
Flash Point:123.7°C
PSA：0.00000
Density:1.064g/cm³
LogP:6.34160
Storage Temp.:Sealed in dry,Room Temperature
XLogP3:7.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:0
Rotatable Bond Count:3
Exact Mass:324.14526
Heavy Atom Count:19
Complexity:273

Purity/Quality:

97% ^*data from raw suppliers

2-Bromo-1,3,5-tri-tert-butylbenzene ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)Br)C(C)(C)C
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.

Technology Process of 2-Bromo-1,3,5-tri-tert-butylbenzene

There total 8 articles about 2-Bromo-1,3,5-tri-tert-butylbenzene which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 76.0%

: 1460-02-2
1,3,5-Tri-tert-butylbenzene

: 3975-77-7
1-bromo-2,4,6-tri-tert-butylbenzene

Guidance literature:: With bromine; at 0 - 80 ℃; for 72h; Inert atmosphere;
DOI:10.1039/d1dt00071c

Reference yield: 55.0%

: 40782-34-1
tris-(tert-butyl)benzene

: 3975-77-7
1-bromo-2,4,6-tri-tert-butylbenzene

Guidance literature:: With bromine; In various solvent(s); for 72h; 4 mol excess of Br₂;
DOI:10.1021/jo00330a017

Reference yield:

: 35383-91-6
2,4,6-tri-tert-butylphenyllithium

: 13465-74-2
bromo trichloro silane

: 3975-77-7
1-bromo-2,4,6-tri-tert-butylbenzene

: 10025-78-2
trichlorosilane

Guidance literature:: With hydrogenchloride; In tetrahydrofuran; diethyl ether; byproducts: LiCl; addn. of soln. of BrSiCl3 in THF to soln. of org.compd. in THF (-78°C), stirring (1 h, -78°C), addn. of HCl in ether; not isolated; (1)H-NMR spectrometry;