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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%
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.
signalword
Warning
hcodes
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
新产品
此项目有
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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