Cas no 122252-67-9 (Methyl 4-(4-fluorophenyl)-2,6-dimethylnicotinate)
Methyl 4-(4-fluorophenyl)-2,6-dimethylnicotinate is a fluorinated nicotinate ester with applications in pharmaceutical and agrochemical research. Its key structural features include a 4-fluorophenyl substituent and methyl ester functionality, which enhance its reactivity and potential as an intermediate in synthetic chemistry. The compound's stability and well-defined crystalline structure facilitate precise handling and purification. Its dimethyl substitution on the pyridine ring contributes to steric hindrance, influencing selectivity in coupling reactions. This compound is particularly valuable in the development of bioactive molecules due to its fluorine moiety, which can improve metabolic stability and binding affinity. Suitable for controlled reactions, it serves as a versatile building block in medicinal chemistry.
122252-67-9 structure
Product Name:Methyl 4-(4-fluorophenyl)-2,6-dimethylnicotinate
CAS No:122252-67-9
MF:C15H14FNO2
MW:259.275567531586
CID:1094532
PubChem ID:9878343
Update Time:2025-10-30
Methyl 4-(4-fluorophenyl)-2,6-dimethylnicotinate Chemical and Physical Properties
Names and Identifiers
-
- Methyl 4-(4-fluorophenyl)-2,6-dimethylnicotinate
- G70544
- SCHEMBL9270449
- Methyl 2,6-dimethyl-4-(4-fluorophenyl)pyridine-3-carboxylate
- 122252-67-9
- Methyl 2,6-dimethyl-4-(4-fluorophenyl)-pyridine-3-carboxylate
- METHYL 4-(4-FLUOROPHENYL)-2,6-DIMETHYLPYRIDINE-3-CARBOXYLATE
- FDOSNDLZHFVRMF-UHFFFAOYSA-N
- Methyl4-(4-fluorophenyl)-2,6-dimethylnicotinate
- 3-Pyridinecarboxylic acid, 4-(4-fluorophenyl)-2,6-dimethyl-, methyl ester
-
- Inchi： 1S/C15H14FNO2/c1-9-8-13(11-4-6-12(16)7-5-11)14(10(2)17-9)15(18)19-3/h4-8H,1-3H3
- InChI Key： FDOSNDLZHFVRMF-UHFFFAOYSA-N
- SMILES： FC1C=CC(=CC=1)C1C=C(C)N=C(C)C=1C(=O)OC
Computed Properties
- Exact Mass: 259.10085685g/mol
- Monoisotopic Mass: 259.10085685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 315
- 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: 3.2
- Topological Polar Surface Area: 39.2?2
Methyl 4-(4-fluorophenyl)-2,6-dimethylnicotinate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A019113696-1g |
Methyl 4-(4-fluorophenyl)-2,6-dimethylnicotinate |
122252-67-9 | 95% | 1g |
$699.72 | 2023-09-03 | |
| Chemenu | CM176912-1g |
methyl 4-(4-fluorophenyl)-2,6-dimethylnicotinate |
122252-67-9 | 95% | 1g |
$830 | 2021-08-05 | |
| Chemenu | CM176912-1g |
methyl 4-(4-fluorophenyl)-2,6-dimethylnicotinate |
122252-67-9 | 95% | 1g |
$830 | 2022-06-13 | |
| 1PlusChem | 1P0017GL-50mg |
3-Pyridinecarboxylic acid, 4-(4-fluorophenyl)-2,6-dimethyl-, methyl ester |
122252-67-9 | 95% | 50mg |
$112.00 | 2023-12-25 | |
| 1PlusChem | 1P0017GL-100mg |
3-Pyridinecarboxylic acid, 4-(4-fluorophenyl)-2,6-dimethyl-, methyl ester |
122252-67-9 | 95% | 100mg |
$176.00 | 2023-12-25 | |
| 1PlusChem | 1P0017GL-250mg |
3-Pyridinecarboxylic acid, 4-(4-fluorophenyl)-2,6-dimethyl-, methyl ester |
122252-67-9 | 95% | 250mg |
$285.00 | 2023-12-25 | |
| 1PlusChem | 1P0017GL-1g |
3-Pyridinecarboxylic acid, 4-(4-fluorophenyl)-2,6-dimethyl-, methyl ester |
122252-67-9 | 95% | 1g |
$721.00 | 2023-12-25 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1762422-1g |
Methyl 4-(4-fluorophenyl)-2,6-dimethylnicotinate |
122252-67-9 | 98% | 1g |
￥6370.00 | 2024-08-09 | |
| Aaron | AR0017OX-50mg |
3-Pyridinecarboxylic acid, 4-(4-fluorophenyl)-2,6-dimethyl-, methyl ester |
122252-67-9 | 95% | 50mg |
$102.00 | 2025-02-17 | |
| Aaron | AR0017OX-100mg |
3-Pyridinecarboxylic acid, 4-(4-fluorophenyl)-2,6-dimethyl-, methyl ester |
122252-67-9 | 95% | 100mg |
$173.00 | 2025-02-17 |
Methyl 4-(4-fluorophenyl)-2,6-dimethylnicotinate Related Literature
-
Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
-
Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
-
Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
-
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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