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Merck
CN

337358

4-碘-2-甲基苯酚

97%

别名:

4-碘邻甲酚

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线性分子式:
IC6H3(CH3)OH
化学文摘社编号:
分子量:
234.03
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
97%
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InChI

1S/C7H7IO/c1-5-4-6(8)2-3-7(5)9/h2-4,9H,1H3

SMILES string

Cc1cc(I)ccc1O

InChI key

WSBDSSKIWDFOBQ-UHFFFAOYSA-N

assay

97%

bp

105-110 °C/2 mmHg (lit.)

mp

67-68 °C (lit.)

functional group

iodo

Quality Level

General description

4-Iodo-2-methylphenol was prepared by direct iodination of 2-methylphenol in aqueous alcohol solvents by the action of a reagent prepared in situ from sodium hypochlorite and sodium iodide.

Application

4-Iodo-2-methylphenol was used as starting reagent in the synthesis of an agonist for the peroxisome proliferator-activated receptor δ (PPARδ) GW501516, a potential antiobesity drug.

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

存储类别

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

法规信息

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历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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An efficient and selective method for the preparation of iodophenols.
Edgar KJ and Falling SN.
The Journal of Organic Chemistry, 55(18), 5287-5291 (1990)
A highly efficient synthesis of antiobestic ligand GW501516 for the peroxisome proliferator-activated receptor d through in situ protection of the phenol group by reaction with a Grignard reagent.
Ham J and Kang H.
Tetrahedron Letters, 46(39), 6683-6686 (2005)

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