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1-tert-Butyl-3,5-dimethylbenzene

ALDRICH/233587 - 98%

Synonym: 5-tert-Butyl-m-xylene; sym.-tert-Butyl-m-xylene

CAS Number: 98-19-1
Empirical Formula (Hill Notation): C12H18
Molecular Weight: 162.27
EC Number: 202-647-6
MDL Number: MFCD00008832
Linear Formula: (CH3)3CC6H3(CH3)2
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-233587-100G 100 g
 $59.40
1/EA		 Add To Favorites
45-233587-500G 500 g
 $237.00
1/EA		 Add To Favorites
This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material. This image depicts SKU: 233587-100G.
This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material. This image depicts SKU: 233587-500G.

 

assay 98%
bp 205-206 °C (lit.)
density 0.867 g/mL at 25 °C (lit.)
form liquid
InChI 1S/C12H18/c1-9-6-10(2)8-11(7-9)12(3,4)5/h6-8H,1-5H3
InChI key FZSPYHREEHYLCB-UHFFFAOYSA-N
Quality Level 100 
refractive index n20/D 1.495 (lit.)
SMILES string Cc1cc(C)cc(c1)C(C)(C)C
Application: 1-tert-Butyl-3,5-dimethylbenzene has been used in the synthesis of bulky, multi-alkylated diaryl disulfides such as bis(4-tert-butyl-2,6-dimethylphenyl) disulfide and bis(2,4,6-triisopropylphenyl) disulfide.
General description: 1-tert-Butyl-3,5-dimethylbenzene participates in the cascade diarylation of N-phenylacetamides with non-prefunctionalized arenes.
Packaging: 100, 500 g in glass bottle
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-36
RIDADR NONH for all modes of transport
WGK Germany WGK 3
Flash Point(F) 154.4 °F - closed cup
Flash Point(C) 68 °C - closed cup
Purity 98%
bp 205-206 °C (lit.)
Density 0.867 g/mL at 25 °C (lit.)
Refractive Index n20/D 1.495 (lit.)
UNSPSC 12352100

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