Cas no 866132-66-3 (Ethyl 2-(2-Pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate)
Ethyl 2-(2-Pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate is a pyrimidine-based heterocyclic compound featuring a trifluoromethyl group and a pyridinyl substituent. This structure imparts unique electronic and steric properties, making it a valuable intermediate in pharmaceutical and agrochemical research. The trifluoromethyl group enhances metabolic stability and lipophilicity, while the pyridine moiety contributes to coordination capabilities in metal-catalyzed reactions. The ethyl ester functionality allows for further derivatization, facilitating its use in the synthesis of more complex molecules. Its well-defined reactivity profile and structural versatility make it a useful building block for developing bioactive compounds, particularly in medicinal chemistry applications targeting enzyme inhibition or receptor modulation.
866132-66-3 structure
Product Name:Ethyl 2-(2-Pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate
CAS No:866132-66-3
MF:C13H10F3N3O2
MW:297.2326130867
MDL:MFCD05668813
CID:1071331
PubChem ID:1485584
Update Time:2025-05-28
Ethyl 2-(2-Pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate Chemical and Physical Properties
Names and Identifiers
-
- Ethyl 2-(pyridin-2-yl)-4-(trifluoromethyl)pyrimidine-5-carboxylate
- Ethyl 2-(2-pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate
- Ethyl 4-(trifluoromethyl)-2-(pyridin-2-yl)pyrimidine-5-carboxylate
- Ethyl 2-(2-pyridinyl)-4-(trifluoromethyl)-5-pyrimidine carboxylate
- J-520653
- ethyl 2-pyridin-2-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate
- Ethyl2-(pyridin-2-yl)-4-(trifluoromethyl)pyrimidine-5-carboxylate
- 866132-66-3
- DTXSID70363331
- AKOS005071088
- MFCD05668813
- 7W-0211
- SR-01000307503-1
- SR-01000307503
- CS-0330796
- Ethyl 2-(2-Pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate
-
- MDL: MFCD05668813
- Inchi: 1S/C13H10F3N3O2/c1-2-21-12(20)8-7-18-11(9-5-3-4-6-17-9)19-10(8)13(14,15)16/h3-7H,2H2,1H3
- InChI Key: PLFLYSSWKISNDL-UHFFFAOYSA-N
- SMILES: FC(C1C(C(=O)OCC)=CN=C(C2C=CC=CN=2)N=1)(F)F
Computed Properties
- Exact Mass: 297.07251106g/mol
- Monoisotopic Mass: 297.07251106g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 21
- Rotatable Bond Count: 5
- Complexity: 365
- 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
- Topological Polar Surface Area: 65?2
Ethyl 2-(2-Pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Matrix Scientific | 045425-500mg |
Ethyl 2-(2-pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate, >95% |
866132-66-3 | >95% | 500mg |
$244.00 | 2023-09-09 | |
| Matrix Scientific | 045425-1g |
Ethyl 2-(2-pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate, >95% |
866132-66-3 | >95% | 1g |
$304.00 | 2023-09-09 | |
| Matrix Scientific | 045425-5g |
Ethyl 2-(2-pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate, >95% |
866132-66-3 | >95% | 5g |
$698.00 | 2023-09-09 | |
| TRC | E029740-250mg |
Ethyl 2-(2-Pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate |
866132-66-3 | 250mg |
$ 220.00 | 2022-06-05 | ||
| TRC | E029740-500mg |
Ethyl 2-(2-Pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate |
866132-66-3 | 500mg |
$ 365.00 | 2022-06-05 | ||
| Chemenu | CM309374-5g |
Ethyl 2-(pyridin-2-yl)-4-(trifluoromethyl)pyrimidine-5-carboxylate |
866132-66-3 | 95% | 5g |
$418 | 2021-08-18 | |
| Chemenu | CM309374-1g |
Ethyl 2-(pyridin-2-yl)-4-(trifluoromethyl)pyrimidine-5-carboxylate |
866132-66-3 | 95% | 1g |
$171 | 2023-02-01 | |
| abcr | AB268921-1 g |
Ethyl 2-(2-pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate, 95%; . |
866132-66-3 | 95% | 1g |
€315.00 | 2023-04-26 | |
| abcr | AB268921-5 g |
Ethyl 2-(2-pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate, 95%; . |
866132-66-3 | 95% | 5g |
€859.90 | 2023-04-26 | |
| abcr | AB268921-10 g |
Ethyl 2-(2-pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate, 95%; . |
866132-66-3 | 95% | 10g |
€1594.20 | 2023-04-26 |
Ethyl 2-(2-Pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylate Related Literature
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
-
Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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