Ethyl 3-iodo-5-methyl-1H-pyrazole-4-carboxylate
Structure Info
- Chemspace ID
- CSSB00119600204 (In-Stock Building Blocks)
- CAS
- 1629095-95-9
- MFCD
- MFCD31926500, MFCD33728403, MFCD31926500 , MFCD33728403
- IUPAC Name
- ethyl 3-iodo-5-methyl-1H-pyrazole-4-carboxylate
- Mol formula
- C7H9IN2O2
- Mol weight
- 280 Da
- Catalog Number(s)
- AG020524, ArZ-UT001473, BBLS00119600204, BBV-136523498, BBV-391997678, BD01457961, CS-0590135, CSC119600204, EN300-23009374, FCH19868485, PBMR1166501, PBXAA902, S79016, TX02067S, Y3622365, bbls00119600204, s_1458_25935708_483918, s_1458____25935708____483918
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.8
- Heavy atoms count
- 12
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.428
- Polar surface area (Å)
- 55
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSB00119600204
Items Overall 18 items from 3 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 200.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 298.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 425.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 668.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 857.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 2.5 g | 1,680.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 5 g | 2,485.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 10 g | 3,683.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 200.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 298.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 425.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 668.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 1 g | 857.00 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 50 umol | 113.58 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 100 umol | 157.89 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 200 umol | 217.00 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 300 umol | 277.00 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 500 umol | 343.00 |
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Substructure Analogs
![Chemical structure of ethyl 2-iodo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-3-carboxylate - CSSB00020783892](/st/structure/200/277713558563bbf94f2ee320c07a1988/CCOC%2528%253DO%2529C1%253DC2CNCCN2N%253DC1I.png)
![Chemical structure of ethyl 2-iodo-4-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-3-carboxylate - CSSB00020783891](/st/structure/200/2f76a43ac5682786d0406e6882b2ba20/CCOC%2528%253DO%2529C1%253DC2N%2528CCNC2%253DO%2529N%253DC1I.png)
Similarity Analogs
![Chemical structure of ethyl 3-[({[4-(ethoxycarbonyl)-5-methyl-1H-pyrazol-3-yl]methyl}disulfanyl)methyl]-5-methyl-1H-pyrazole-4-carboxylate - CSSB00121697472](/st/structure/200/72746b1b06282d0a1c8834e7986b2edb/CCOC%2528%253DO%2529C1%253DC%2528C%2529NN%253DC1CSSCC1%253DNNC%2528C%2529%253DC1C%2528%253DO%2529OCC.png)
