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Safety Information

532568

Sigma-Aldrich

Methyl 3-iodo-4-methoxybenzoate

98%

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About This Item

Linear Formula:
CH3OC6H3(I)CO2CH3
CAS Number:
35387-93-0
Molecular Weight:
292.07
MDL number:
MFCD00052925
UNSPSC Code:
12352100
PubChem Substance ID:
24877895
NACRES:
NA.22

Assay

98%

mp

92-95 °C (lit.)

SMILES string

COC(=O)c1ccc(OC)c(I)c1

InChI

1S/C9H9IO3/c1-12-8-4-3-6(5-7(8)10)9(11)13-2/h3-5H,1-2H3

InChI key

GHNGBFHLUOJHKP-UHFFFAOYSA-N

Application

Methyl 3-iodo-4-methoxybenzoate (1,3-Dimethyl-1H-pyrazol-5-amine) may be used in the preparation of:
  • methyl 3-[3-(N,N-dimethylamino)prop-1-ynyl]-4-methoxybenzoate
  • 3,4,5,2′-tetramethoxybiphenyl
  • 5-propyl-3-ol-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
MKCL1154
MKBN7016V
MKBB2727
01018LH
05008KI

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Aucuparin and Methoxyaucuparin, Two Phenolic Biphenyl.
Erdtman H, et al.
Acta Chemica Scandinavica, 17(4), 1151-1156 (1963)
M Lamothe et al.
Journal of medicinal chemistry, 40(22), 3542-3550 (1997-11-14)
The synthesis and binding affinity at cloned h5-HT1D, h5-HT1D, and h5-HT1A receptors of 3-[3-(N,N-dimethylamino)propyl]-4-hydroxy- N-[4-(pyridin-4-yl)phenyl]benzamide (2, GR-55562) and four O-methylated analogs are described. The functional activity of these compounds was determined at the h5-HT1B receptor using a [35S]GTP gamma S
Sandip B Bharate et al.
Bioorganic & medicinal chemistry, 16(15), 7167-7176 (2008-07-16)
In the present article, we have synthesized three different series of pyrazolo[3,4-b]pyridines and their structural analogues using novel synthetic strategy involving one-pot condensation of 5,6-dihydro-4H-pyran-3-carbaldehyde/2-formyl-3,4,6-tri-O-methyl-D-glucal/chromone-3-carbaldehyde with heteroaromatic amines. All synthesized compounds were evaluated for their anti-inflammatory activity against TNF-alpha and

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