Skip to Content
Merck
CN

Key Documents

View All Documentation

392499

1-Iodo-3,4-dimethylbenzene

99%

Synonym(s):

4-Iodo-o-xylene

Sign In to View Organizational & Contract Pricing.

Select a Size

Change View

About This Item

Linear Formula:
(CH3)2C6H3I
CAS Number:
31599-61-8
Molecular Weight:
232.06
NACRES:
NA.22
PubChem Substance ID:
24864459
UNSPSC Code:
12352100
MDL number:
MFCD00040989
Assay:
99%
Form:
liquid
Technical Service
Need help? Our team of experienced scientists is here for you.
Let Us Assist

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

pictograms

Exclamation mark
GHS07

signalword

Warning

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

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

新产品

This item has

Choose from one of the most recent versions:

Certificates of Analysis (COA)

Lot/Batch Number
BCBZ3703
BCBV3009
BCBS8568V
BCBQ4077V
BCBM3839V

Don't see the Right Version?

If you require a particular version, you can look up a specific certificate by the Lot or Batch number.

Search for a COA

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

Synthesis of 3-arylpropylamine derivatives from aryl halides using Heck reaction.
Baek GH, et al.
Bull. Korean Chem. Soc., 20, 232-236 (1999)
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
View All Related Papers

Global Trade Item Number

SKUGTIN
392499-10ML04061831981544