392499
1-Iodo-3,4-dimethylbenzene
99%
Synonym(s):
4-Iodo-o-xylene
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About This Item
Linear Formula:
(CH3)2C6H3I
CAS Number:
Molecular Weight:
232.06
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Recommended Products
Assay
99%
form
liquid
refractive index
n20/D 1.603 (lit.)
bp
106-108 °C/13 mmHg (lit.)
density
1.633 g/mL at 25 °C (lit.)
SMILES string
Cc1ccc(I)cc1C
InChI
1S/C8H9I/c1-6-3-4-8(9)5-7(6)2/h3-5H,1-2H3
InChI key
CSFRCLYFVINMBZ-UHFFFAOYSA-N
General description
1-Iodo-3,4-dimethylbenzene (4-iodo-o-xylene, 3,4-dimethyliodobenzene) is an aryl halide. Its synthesis, NMR and IR spectra has been reported. Its nitration reaction and copper catalyzed trifluoromethylation reaction has been studied.
Application
1-Iodo-3,4-dimethylbenzene (4-iodo-o-xylene, 3,4-dimethyliodobenzene) may be used in the synthesis of the following:
- 3-arylacrylamide
- 3,3-diaryl substituted acrylamide
- 3-arylpropylamine
- di-tert-butyl 1-(3,4-dimethylphenyl)hydrazine-1,2-dicarboxylate
- 2,3,7,8-tetramethyldibenzofuran
- N-(3-(3,4-Dimethylphenyl)-2-phthalimidopropionyl)-2-methylthioaniline
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
10 - Combustible liquids
WGK
WGK 3
Flash Point(F)
235.4 °F - closed cup
Flash Point(C)
113 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Synthesis of 3-arylpropylamine derivatives from aryl halides using Heck reaction.
Baek GH, et al.
Bull. Korean Chem. Soc., 20, 232-236 (1999)
Efficient and direct iodination of alkyl benzenes using polymer/HIO4 and I2 under mild condition.
Pourali AR, et al.
Bulletin of the Chemical Society of Ethiopia, 28(2), 305-308 (2014)
ipso-Nitration of 4-iodo-o-xylene.
Zweig A, et al.
The Journal of Organic Chemistry, 42(25), 4049-4052 (1977)
Martyn Inman et al.
The Journal of organic chemistry, 77(3), 1217-1232 (2011-10-08)
In a new variation on the Fischer indole synthesis, readily available haloarenes are converted into a wide range of indoles in just two steps by halogen-magnesium exchange and quenching with di-tert-butyl azodicarboxylate, followed by reaction with aldehydes or ketones under
Synthesis of 2, 3, 7, 8-tetramethyldibenzofuran.
Mazere IV, et al.
Chemistry of Heterocyclic Compounds, 8(12), 1446-1448 (1972)
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