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About This Item
Linear Formula:
(CH3)2C6H3Cl
CAS Number:
Molecular Weight:
140.61
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
229-843-4
MDL number:
Product Name
2-Chloro-1,3-dimethylbenzene, 97%
InChI key
VDXLAYAQGYCQEO-UHFFFAOYSA-N
InChI
1S/C8H9Cl/c1-6-4-3-5-7(2)8(6)9/h3-5H,1-2H3
SMILES string
Cc1cccc(C)c1Cl
assay
97%
form
liquid
refractive index
n20/D 1.527 (lit.)
bp
182-183 °C (lit.)
mp
−36 °C (lit.)
density
1.061 g/mL at 25 °C (lit.)
functional group
chloro
General description
Suzuki coupling reaction of 2-chloro-1,3-dimethylbenzene with arylboronic acids has been investigated. 2-Chloro-1,3-dimethylbenzene undergoes palladium-catalyzed cyanation reaction to afford 2,6-dimethyl benzonitrile.
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
145.4 °F - closed cup
flash_point_c
63 °C - closed cup
ppe
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
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A practical heterogeneous catalyst for the Suzuki, Sonogashira, and Stille coupling reactions of unreactive aryl chlorides.
Myung-Jong Jin et al.
Angewandte Chemie (International ed. in English), 49(6), 1119-1122 (2010-01-01)
A new palladium catalyst system for the cyanation of aryl chlorides with K4[Fe(CN)6].
Schareina T, et al.
Tetrahedron Letters, 48(7), 1087-1090 (2007)
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