ChemicalBook > CAS DataBase List > 1H-Pyrazole-3-carboxylic acid, 4-iodo-, methyl ester

1H-Pyrazole-3-carboxylic acid, 4-iodo-, methyl ester

Product Name
1H-Pyrazole-3-carboxylic acid, 4-iodo-, methyl ester
CAS No.
136944-79-1
Chemical Name
1H-Pyrazole-3-carboxylic acid, 4-iodo-, methyl ester
Synonyms
MFCD09473436;methyl 4-iodo-1H-pyrazole-5-carboxylate;4-Iodo-1H-pyrazole-3-carboxylic acid methyl ester;1H-Pyrazole-3-carboxylic acid, 4-iodo-, methyl ester
CBNumber
CB31509206
Molecular Formula
C5H5IN2O2
Formula Weight
252.01
MOL File
136944-79-1.mol
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1H-Pyrazole-3-carboxylic acid, 4-iodo-, methyl ester Property

Boiling point:
338.5±22.0 °C(Predicted)
Density 
2.083±0.06 g/cm3(Predicted)
storage temp. 
2-8°C, protect from light
pka
10.03±0.50(Predicted)
Appearance
White to off-white Solid
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P270Do not eat, drink or smoke when using this product.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P301+P312IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.

P302+P352IF ON SKIN: wash with plenty of soap and water.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P321Specific treatment (see … on this label).

P330Rinse mouth.

P332+P313IF SKIN irritation occurs: Get medical advice/attention.

P362Take off contaminated clothing and wash before reuse.

P501Dispose of contents/container to..…

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N-Bromosuccinimide Price

TRC
Product number
M324575
Product name
methyl4-iodo-1H-pyrazole-3-carboxylate
Packaging
100mg
Price
$65
Updated
2021/12/16
AK Scientific
Product number
6533AA
Product name
Methyl4-iodo-1H-pyrazole-3-carboxylate
Packaging
250mg
Price
$199
Updated
2021/12/16
Matrix Scientific
Product number
159613
Product name
Methyl 4-iodo-1H-pyrazole-5-carboxylate
Packaging
0.500g
Price
$240
Updated
2021/12/16
Matrix Scientific
Product number
159613
Product name
Methyl 4-iodo-1H-pyrazole-5-carboxylate
Packaging
1g
Price
$300
Updated
2021/12/16
AK Scientific
Product number
6533AA
Product name
Methyl4-iodo-1H-pyrazole-3-carboxylate
Packaging
1g
Price
$319
Updated
2021/12/16
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1H-Pyrazole-3-carboxylic acid, 4-iodo-, methyl ester Chemical Properties,Usage,Production

Synthesis

15366-34-4

136944-79-1

Methyl 1H-pyrazole-3-carboxylate (0.5 g, 4.3 mmol, 1.1 eq.) and N-iodosuccinimide (NIS) (0.97 g, 3.9 mmol, 1 eq.) were dissolved in acetonitrile (15 mL), and trifluoroacetic acid (0.1 mL) was added as a catalyst. The reaction mixture was stirred at room temperature for 3 hours. Upon completion of the reaction, the mixture was concentrated to remove the solvent. The concentrated residue was partitioned between ethyl acetate (EtOAc) and 5% aqueous sodium bicarbonate (NaHCO3). The organic layer was separated, dried with anhydrous sodium sulfate (Na2SO4), filtered and concentrated. Finally, the residue was purified by silica gel column chromatography to afford the target product methyl 4-iodo-1H-pyrazole-3-carboxylate (0.61 g, 61% yield).

References

[1] Journal of Medicinal Chemistry, 2008, vol. 51, # 1, p. 159 - 166
[2] Patent: WO2018/11628, 2018, A1. Location in patent: Paragraph 00315
[3] Russian Chemical Bulletin, 2010, vol. 59, # 8, p. 1549 - 1555

1H-Pyrazole-3-carboxylic acid, 4-iodo-, methyl ester Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 1H-Pyrazole-3-carboxylic acid, 4-iodo-, methyl ester manufacturers

Career Henan Chemical Co
Product
1H-Pyrazole-3-carboxylic acid, 4-iodo-, methyl ester 136944-79-1
Price
US $1.00/KG
Min. Order
1KG
Purity
99%
Supply Ability
200kgs
Release date
2020-02-19

136944-79-1, 1H-Pyrazole-3-carboxylic acid, 4-iodo-, methyl esterRelated Search:


  • 1H-Pyrazole-3-carboxylic acid, 4-iodo-, methyl ester
  • 4-Iodo-1H-pyrazole-3-carboxylic acid methyl ester
  • methyl 4-iodo-1H-pyrazole-5-carboxylate
  • MFCD09473436
  • 136944-79-1