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About This Item
Linear Formula:
(CH3)2C6H3Br
CAS Number:
Molecular Weight:
185.06
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
209-397-7
Beilstein/REAXYS Number:
1929780
MDL number:
Assay:
98%
InChI
1S/C8H9Br/c1-6-4-3-5-7(2)8(6)9/h3-5H,1-2H3
InChI key
MYMYVYZLMUEVED-UHFFFAOYSA-N
SMILES string
Cc1cccc(C)c1Br
assay
98%
refractive index
n20/D 1.555 (lit.)
bp
206 °C (lit.)
mp
−10 °C (lit.)
density
1.389 g/mL at 25 °C (lit.)
functional group
bromo
Quality Level
Related Categories
Application
2-Bromo-1,3-dimethylbenzene has been used to prepare 2,2′,4,6,6′-pentamethylbiphenyl.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
165.2 °F - closed cup
flash_point_c
74 °C - closed cup
ppe
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
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Andreas Schmidt et al.
Chemical communications (Cambridge, England), 46(17), 2995-2997 (2010-04-14)
The catalyst system consisting of 3,3'-(3,4-bis(dichloro-methylene)cyclobut-1-ene-1,2-diyl)bis(1-methyl-1H-imidazolium) bis(tetrafluoroborate), Pd(OAc)(2) and NaOtBu in toluene proved to be very effective for a broad variety of Suzuki-Miyaura reactions at room temperature. It is also suited for the synthesis of sterically hindered compounds including 2,6-di-tert-butyl-2'-substituted
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