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About This Item
Linear Formula:
(CH3)2C6H3OCH3
CAS Number:
Molecular Weight:
136.19
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
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Assay
97%
refractive index
n20/D 1.514 (lit.)
bp
191 °C (lit.)
density
0.973 g/mL at 25 °C (lit.)
SMILES string
COc1ccc(C)cc1C
InChI
1S/C9H12O/c1-7-4-5-9(10-3)8(2)6-7/h4-6H,1-3H3
InChI key
UJCFZCTTZWHRNL-UHFFFAOYSA-N
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Application
2,4-Dimethylanisole was used to study the solvolysis of 1,4-dimethyl-4-nitrocyclohexa-2,5-dien-1. It was used to study the photolysis of charge transfer complex of 2,4-dimethylanisole with tetranitromethane.
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Oral - Aquatic Chronic 2 - Eye Dam. 1 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
10 - Combustible liquids
WGK
WGK 3
Flash Point(F)
145.4 °F - closed cup
Flash Point(C)
63 °C - closed cup
Regulatory Information
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The role of ion-molecule pair intermediates in acid-catalyzed solvolysis. General base-catalyzed formation of 4-methylbenzyl carbocation and its trapping by nucleophiles.
Thibblin A.
The Journal of Organic Chemistry, 58(26), 7427-7433 (1993)
Photochemical Nitration by Tetranitromethane. Part XXXVII. t Adduct Formation and the Regiochemistry of Attack of Trinitromethanide Ion on Radical Cations in the Photochemical Reactions of 2-Methyl-, 2, 3-Dimethyl-and 2, 4-Dimethylanisoles.
Timmerman-Vaughan DJ.
Acta Chemica Scandinavica, 51(19971), 73-87 (1997)
Reactions of the 1-hydroxy-1, 4-dimethylcyclohexadienyl cation, an intermediate in the solvolysis of 1, 4-dimethyl-4-nitrocyclohexa-2, 5-dien-1-ol.
Fischer A, et al.
Canadian Journal of Chemistry, 64(6), 1093-1101 (1986)
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