Cas no 53960-15-9 (Ethyl 5-Methoxy-1-phenyl-1H-pyrazole-3-carboxylate)
Ethyl 5-Methoxy-1-phenyl-1H-pyrazole-3-carboxylate is a pyrazole-based ester compound with notable applications in pharmaceutical and agrochemical research. Its structural features, including the methoxy and phenyl substituents, contribute to its versatility as an intermediate in organic synthesis. The compound exhibits favorable stability under standard conditions and demonstrates compatibility with various reaction conditions, making it suitable for further functionalization. Its well-defined molecular structure allows for precise modifications, enabling the development of targeted bioactive molecules. The ester group enhances solubility in common organic solvents, facilitating handling in laboratory settings. This compound is particularly valuable for researchers exploring heterocyclic chemistry and seeking to develop novel pyrazole derivatives with potential biological activity.
53960-15-9 structure
Product Name:Ethyl 5-Methoxy-1-phenyl-1H-pyrazole-3-carboxylate
CAS No:53960-15-9
MF:C13H14N2O3
MW:246.261863231659
CID:355991
PubChem ID:12334789
Update Time:2025-10-29
Ethyl 5-Methoxy-1-phenyl-1H-pyrazole-3-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazole-3-carboxylic acid, 5-methoxy-1-phenyl-, ethyl ester
- ethyl 5-methoxy-1-phenylpyrazole-3-carboxylate
- NS-03560
- ethyl5-methoxy-1-phenyl-1H-pyrazole-3-carboxylate
- ethyl 5-methoxy-1-phenyl-1H-pyrazole-3-carboxylate
- DTXSID70491087
- 53960-15-9
- AKOS027460599
- Ethyl 5-Methoxy-1-phenyl-1H-pyrazole-3-carboxylate
-
- Inchi： 1S/C13H14N2O3/c1-3-18-13(16)11-9-12(17-2)15(14-11)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
- InChI Key： ACOYTVKWAQINBN-UHFFFAOYSA-N
- SMILES： O(C)C1=CC(C(=O)OCC)=NN1C1C=CC=CC=1
Computed Properties
- Exact Mass: 246.10052
- Monoisotopic Mass: 246.10044231g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 279
- 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: 2.7
- Topological Polar Surface Area: 53.4?2
Experimental Properties
- PSA: 53.35
Ethyl 5-Methoxy-1-phenyl-1H-pyrazole-3-carboxylate Security Information
- Signal Word：warning
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
Ethyl 5-Methoxy-1-phenyl-1H-pyrazole-3-carboxylate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | B442463-10mg |
Ethyl 5-Methoxy-1-phenyl-1H-pyrazole-3-carboxylate |
53960-15-9 | 10mg |
$ 70.00 | 2022-06-07 | ||
| TRC | B442463-50mg |
Ethyl 5-Methoxy-1-phenyl-1H-pyrazole-3-carboxylate |
53960-15-9 | 50mg |
$ 230.00 | 2022-06-07 | ||
| TRC | B442463-100mg |
Ethyl 5-Methoxy-1-phenyl-1H-pyrazole-3-carboxylate |
53960-15-9 | 100mg |
$ 340.00 | 2022-06-07 | ||
| OTAVAchemicals | 11639200-50MG |
ethyl 5-methoxy-1-phenyl-1H-pyrazole-3-carboxylate |
53960-15-9 | 95% | 50MG |
$130 | 2023-07-07 | |
| OTAVAchemicals | 11639200-250MG |
ethyl 5-methoxy-1-phenyl-1H-pyrazole-3-carboxylate |
53960-15-9 | 95% | 250MG |
$259 | 2023-07-07 | |
| OTAVAchemicals | 11639200-1000MG |
ethyl 5-methoxy-1-phenyl-1H-pyrazole-3-carboxylate |
53960-15-9 | 95% | 1g |
$680 | 2023-07-07 | |
| A2B Chem LLC | AO83913-50mg |
Ethyl 5-methoxy-1-phenyl-1H-pyrazole-3-carboxylate |
53960-15-9 | 95% | 50mg |
$345.00 | 2024-04-19 | |
| A2B Chem LLC | AO83913-250mg |
Ethyl 5-methoxy-1-phenyl-1H-pyrazole-3-carboxylate |
53960-15-9 | 95% | 250mg |
$488.00 | 2024-04-19 | |
| A2B Chem LLC | AO83913-1g |
Ethyl 5-methoxy-1-phenyl-1H-pyrazole-3-carboxylate |
53960-15-9 | 95% | 1g |
$956.00 | 2024-04-19 |
Ethyl 5-Methoxy-1-phenyl-1H-pyrazole-3-carboxylate Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
-
Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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