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529087

Sigma-Aldrich

2-Chloro-5-iodotoluene

98%

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About This Item

Linear Formula:
ClC6H3(I)CH3
CAS Number:
116632-41-8
Molecular Weight:
252.48
MDL number:
MFCD03093903
UNSPSC Code:
12352100
PubChem Substance ID:
24877644
NACRES:
NA.22

assay

98%

refractive index

n20/D 1.624 (lit.)

bp

239 °C (lit.)

density

1.81 g/mL at 25 °C (lit.)

SMILES string

Cc1cc(I)ccc1Cl

InChI

1S/C7H6ClI/c1-5-4-6(9)2-3-7(5)8/h2-4H,1H3

InChI key

MMBDKGFWRIYSRD-UHFFFAOYSA-N

General description

2-Chloro-5-iodotoluene is a halogenated hydrocarbon.

Application

2-Chloro-5-iodotoluene may be used to synthesize:
  • 1-(4-chloro-3-methylphenyl)-1H-pyrrolo[2,3-c]pyridine[1]
  • bromomethyl-2-chloro-5-iodobenzene[2]
  • 3-(4′-chloro-3′-tolyl)thiophene[3]

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

230.0 °F - closed cup

flash_point_c

110 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
MKBJ9645V
MKBJ4370V
MKBC2320
08204DJ
09713DI

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Frédéric Stauffer et al.
Bioorganic & medicinal chemistry letters, 22(5), 1860-1863 (2012-02-18)
Aromatase inhibition is the new standard of care for estrogen receptor positive breast cancer and has also potential for treatment of other diseases such as endometriosis. Simple and readily available 3-pyridyl arylethers and 1-aryl pyrrolo[2,3-c]pyridines recapitulating the key pharmacophore elements
Synthesis and characterization of all-conjugated graft copolymers comprised of n-type or p-type backbones and poly (3-hexylthiophene) side chains.
Wang J, et al.
Macromolecules, 46(5), 1783-1793 (2013)
Susanna Tchilibon et al.
Journal of medicinal chemistry, 48(6), 1745-1758 (2005-03-18)
A series of ring-constrained (N)-methanocarba-5'-uronamide 2,N(6)-disubstituted adenine nucleosides have been synthesized via Mitsunobu condensation of the nucleobase precursor with a pseudosugar ring containing a 5'-ester functionality. Following appropriate functionalization of the adenine ring, the ester group was converted to the

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