tert-Butyl 4-iodopyrazole-1-carboxylate
- CAS No.
- 121669-70-3
- Chemical Name:
- tert-Butyl 4-iodopyrazole-1-carboxylate
- Synonyms
- 1-BOC-4-IODOPYRAZOLE;1-Boc-4-iodopyrazole 95%;t-Butyl4-iodopyrazole-1-carboxylate;1-Boc-4-iodopyrazole, CAS 121669-70-3;TERT-BUTYL 4-IODOPYRAZOLE-1-CARBOXYLATE;T-BUTYL 4-IODO-1H-PYRAZOLE-1-CARBOXYLATE;ert-Butyl4-iodo-1H-pyrazole-1-carboxylate;tert-Butyl-4-iodo-1H-pyrazole-1-carboxylate;3-tert-butyl-4-iodo-1H-pyrazole-1-carboxylate;4-iodo-1-pyrazolecarboxylic acid tert-butyl ester
- CBNumber:
- CB3664975
- Molecular Formula:
- C8H11IN2O2
- Molecular Weight:
- 294.09
- MDL Number:
- MFCD05663855
- MOL File:
- 121669-70-3.mol
- MSDS File:
- SDS
- TDS File:
- TDS
| Melting point | 67-70°C |
|---|---|
| Boiling point | 312.0±34.0 °C(Predicted) |
| Density | 1.70±0.1 g/cm3(Predicted) |
| storage temp. | 2-8°C(protect from light) |
| pka | -3.01±0.12(Predicted) |
| Appearance | White to off-white Solid |
| InChI | InChI=1S/C8H11IN2O2/c1-8(2,3)13-7(12)11-5-6(9)4-10-11/h4-5H,1-3H3 |
| InChIKey | WRCRIGRVTPLDDD-UHFFFAOYSA-N |
| SMILES | N1(C(OC(C)(C)C)=O)C=C(I)C=N1 |
SAFETY
Risk and Safety Statements
| Symbol(GHS) |  GHS07 |
|---|---|
| Signal word | Warning |
| Hazard statements | H302-H315-H319-H335 |
| Precautionary statements | P261-P305+P351+P338 |
| Hazard Codes | Xn |
| Risk Statements | 36/37/38-22 |
| Safety Statements | 26-36/37/39 |
| HS Code | 2933992000 |
tert-Butyl 4-iodopyrazole-1-carboxylate price More Price(58)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| Apolloscientific | OR302567 | tert-Butyl 4-iodo-1H-pyrazole-1-carboxylate 97% | 121669-70-3 | 250mg | $21 | 2026-06-04 | Buy |
| Apolloscientific | OR302567 | tert-Butyl 4-iodo-1H-pyrazole-1-carboxylate 97% | 121669-70-3 | 1g | $24 | 2026-06-04 | Buy |
| Apolloscientific | OR302567 | tert-Butyl 4-iodo-1H-pyrazole-1-carboxylate 97% | 121669-70-3 | 5g | $49 | 2026-06-04 | Buy |
| Apolloscientific | OR302567 | tert-Butyl 4-iodo-1H-pyrazole-1-carboxylate 97% | 121669-70-3 | 25g | $100 | 2026-06-04 | Buy |
| Apolloscientific | OR302567 | tert-Butyl 4-iodo-1H-pyrazole-1-carboxylate 97% | 121669-70-3 | 100g | $372 | 2026-06-04 | Buy |
tert-Butyl 4-iodopyrazole-1-carboxylate Chemical Properties, Uses, Production
Synthesis
3469-69-0
24424-99-5
121669-70-3
At room temperature, 4-iodopyrazole (20 mmol) was dissolved in THF (60 mL) and Et3N (30 mmol) and di-tert-butyl dicarbonate (Boc) 2O (22 mmol) were added sequentially. After 2 hours of reaction, N-Boc-4-iodopyrazole (5.88 g, 100% yield) was obtained. Subsequently, N-Boc-4-iodopyrazole was dissolved in THF (100 mL) under nitrogen protection, Pd(Ph3P)4 (1.1 g, 1 mmol) and hexamethyldistannane (20 mmol) were added, and the reaction was carried out at 78 °C overnight. After completion of the reaction, 10% KF aqueous solution was added, stirred for 30 min and filtered through a diatomaceous earth pad. The filtrate was extracted with EtOAc, the organic layer was washed with water and dried over MgSO4. After filtration and concentration, it was purified by column chromatography to give 3-trimethylstannopyrazole derivative (5 g, 75% yield) as a white solid.
References
[1] Patent: EP946508, 2009, B1. Location in patent: Page/Page column 58
[2] Patent: WO2012/123745, 2012, A1. Location in patent: Page/Page column 64
[3] Angewandte Chemie - International Edition, 2013, vol. 52, # 32, p. 8290 - 8294
[4] Angew. Chem., 2013, vol. 125, # 32, p. 8448 - 8452,5
[5] Journal of Medicinal Chemistry, 2013, vol. 56, # 24, p. 10045 - 10065
tert-Butyl 4-iodopyrazole-1-carboxylate Preparation Products And Raw materials
Raw materials
Preparation Products
| Supplier | Tel | Country | ProdList | Advantage | |
|---|---|---|---|---|---|
| Meryer (Shanghai) Chemical Technology Co., Ltd. | 4006356688 18621169109 | market03@meryer.com | China | 40202 | 62 |
| Energy Chemical | 400-0056266 | sales8178@energy-chemical.com | China | 45000 | 61 |
| Wuhan Chemwish Technology Co., Ltd | 86-027-67849912 | sales@chemwish.com | China | 35884 | 56 |
| Tetranov Biopharm | 13526569071 | sales@leadmedpharm.com | China | 7880 | 64 |
| Adamas Reagent, Ltd. | 4006009262 13023226327 | hmj@titansci.com | China | 14098 | 59 |
| Accela ChemBio Co.,Ltd. | 4000665055 | marketing@accelachem.com | China | 10972 | 64 |
| Shandong Xiya Chemical Co., Ltd | 13355009207 13355009207 | 3007715519@qq.com | China | 18722 | 57 |
| Shanghai Jian Chao Chemical Technology Co., Ltd. | 150-2103-5486 18017383231 | 983544897@qq.com | China | 9335 | 55 |
| 9ding chemical ( Shanghai) Limited | 4009209199 | sales@9dingchem.com | China | 18201 | 56 |
| Chem-Stone Co.,Ltd. | 020-82185713,82185709 13418171485 | sales@chem-stone.com | China | 743 | 56 |
View Latest Price from tert-Butyl 4-iodopyrazole-1-carboxylate manufacturers
| Image | Update time | Product | Price | Min. Order | Purity | Supply Ability | Manufacturer | |
|---|---|---|---|---|---|---|---|---|
 |
2019-12-27 | tert-Butyl 4-iodopyrazole-1-carboxylate
121669-70-3
|
$1.00 | 1KG | 99% | 200kg | Career Henan Chemical Co |
-
- tert-Butyl 4-iodopyrazole-1-carboxylate
121669-70-3
- $1.00
- 99%
- Career Henan Chemical Co
