Cas no 1401562-12-6 (3-(Ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid)
3-(Ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid is a versatile heterocyclic compound featuring both an ethoxycarbonyl and a carboxylic acid functional group. Its pyrazole core makes it a valuable intermediate in organic synthesis, particularly for the preparation of pharmaceuticals, agrochemicals, and coordination complexes. The presence of two reactive sites allows for selective modifications, enabling the construction of diverse molecular architectures. This compound exhibits good stability under standard conditions, facilitating handling and storage. Its well-defined reactivity profile makes it suitable for use in multi-step synthetic routes, including condensation and cyclization reactions. Researchers value this derivative for its utility in medicinal chemistry and material science applications.
1401562-12-6 structure
Product Name:3-(Ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid
CAS No:1401562-12-6
MF:C7H8N2O4
MW:184.149421691895
CID:1089156
PubChem ID:71721403
Update Time:2025-06-07
3-(Ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 3-(Ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid
- 5-ethoxycarbonyl-1H-pyrazole-3-carboxylic acid
- 3-Ethyl 1H-pyrazole-3,5-dicarboxylate
- CS-0309180
- EN300-1663742
- DTXSID50857001
- AKOS022174391
- BGC56212
- F73404
- 3-(Ethoxycarbonyl)-1H-pyrazole-5-carboxylicacid
- 5-(Ethoxycarbonyl)-1H-pyrazole-3-carboxylic acid
- MFCD21332838
- Z1486031012
- 1401562-12-6
-
- Inchi： 1S/C7H8N2O4/c1-2-13-7(12)5-3-4(6(10)11)8-9-5/h3H,2H2,1H3,(H,8,9)(H,10,11)
- InChI Key： SUQSZNZPCNIEFJ-UHFFFAOYSA-N
- SMILES： O(CC)C(C1=CC(C(=O)O)=NN1)=O
Computed Properties
- Exact Mass: 184.04840674g/mol
- Monoisotopic Mass: 184.04840674g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 219
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.6
- Topological Polar Surface Area: 92.3?2
3-(Ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM188365-1g |
3-(ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid |
1401562-12-6 | 95% | 1g |
$549 | 2021-08-05 | |
| Chemenu | CM188365-1g |
3-(ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid |
1401562-12-6 | 95% | 1g |
$1122 | 2023-02-02 | |
| Alichem | A049002924-1g |
3-(Ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid |
1401562-12-6 | 95% | 1g |
$469.26 | 2022-04-02 | |
| eNovation Chemicals LLC | Y1247663-100mg |
3-(Ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid |
1401562-12-6 | 95% | 100mg |
$195 | 2024-06-06 | |
| eNovation Chemicals LLC | Y1247663-250mg |
3-(Ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid |
1401562-12-6 | 95% | 250mg |
$365 | 2024-06-06 | |
| eNovation Chemicals LLC | Y1247663-1g |
3-(Ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid |
1401562-12-6 | 95% | 1g |
$1060 | 2024-06-06 | |
| Enamine | EN300-1663742-0.05g |
3-(ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid |
1401562-12-6 | 95% | 0.05g |
$245.0 | 2023-07-10 | |
| Enamine | EN300-1663742-0.1g |
3-(ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid |
1401562-12-6 | 95% | 0.1g |
$366.0 | 2023-07-10 | |
| Enamine | EN300-1663742-0.25g |
3-(ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid |
1401562-12-6 | 95% | 0.25g |
$524.0 | 2023-07-10 | |
| Enamine | EN300-1663742-0.5g |
3-(ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid |
1401562-12-6 | 95% | 0.5g |
$824.0 | 2023-07-10 |
3-(Ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid Related Literature
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
1401562-12-6 (3-(Ethoxycarbonyl)-1H-pyrazole-5-carboxylic acid) Related Products
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- 60612-93-3(1H-Pyrazole-3-carboxylic acid, 5-[(acetyloxy)methyl]-, methyl ester)
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- 21056-77-9(Ethyl 1H-pyrazole-5-carboxylate)
- 60659-20-3(1H-Pyrazole-3-carboxylic acid, 5-[(acetyloxy)methyl]-, ethyl ester)
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