- Preparation of indenoisoquinolinone analogs for treating and preventing diseases, World Intellectual Property Organization, , ,
Cas no 93340-09-1 (Methyl 3-cyano-2-methylbenzoate)
Methyl 3-cyano-2-methylbenzoate Chemical and Physical Properties
Names and Identifiers
-
- Methyl 3-cyano-2-methylbenzoate
- 3-cyano-2-methyl-benzoic acid methyl ester
- KB-54114
- Benzoic acid, 3-cyano-2-methyl-, methyl ester
- SureCN646271
- methyl 3-cyano-o-toluate
- 3-Cyan-2-methyl-benzoesaeure-methylester
- AGN-PC-00L9HY
- 3-Cyano-2-methylBenzoic acid methyl ester
- o-Toluic acid, 3-cyano-, methyl ester (6CI)
- CS-0134946
- DTXSID30524446
- DB-017996
- 3-Cyano-2-methylBenzoic acid methyl ester
- methyl3-cyano-2-methylbenzoate
- F53204
- 93340-09-1
- BS-46069
- FHBWZNLFBLOUKX-UHFFFAOYSA-N
- MFCD14584407
- SCHEMBL646271
- SY244571
-
- MDL: MFCD14584407
- Inchi: 1S/C10H9NO2/c1-7-8(6-11)4-3-5-9(7)10(12)13-2/h3-5H,1-2H3
- InChI Key: FHBWZNLFBLOUKX-UHFFFAOYSA-N
- SMILES: N#CC1C(C)=C(C(OC)=O)C=CC=1
Computed Properties
- Exact Mass: 175.063328530g/mol
- Monoisotopic Mass: 175.063328530g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 241
- 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: 1.9
- Topological Polar Surface Area: 50.1?2
Methyl 3-cyano-2-methylbenzoate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| CHENG DOU FEI BO YI YAO Technology Co., Ltd. | FB02861-5g |
Methyl 3-cyano-2-methylbenzoate |
93340-09-1 | 95% | 5g |
$650 | 2023-09-07 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | M85000-1g |
METHYL 3-CYANO-2-METHYLBENZOATE |
93340-09-1 | 95% | 1g |
¥119.0 | 2024-07-19 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | M85000-5g |
METHYL 3-CYANO-2-METHYLBENZOATE |
93340-09-1 | 95% | 5g |
¥540.0 | 2024-07-19 | |
| Ambeed | A991305-1g |
Methyl 3-cyano-2-methylbenzoate |
93340-09-1 | 95% | 1g |
$34.0 | 2025-04-15 | |
| Ambeed | A991305-5g |
Methyl 3-cyano-2-methylbenzoate |
93340-09-1 | 95% | 5g |
$92.0 | 2025-04-15 | |
| Ambeed | A991305-10g |
Methyl 3-cyano-2-methylbenzoate |
93340-09-1 | 95% | 10g |
$124.0 | 2025-04-15 | |
| eNovation Chemicals LLC | Y0997285-5g |
methyl 3-cyano-2-methylbenzoate |
93340-09-1 | 95% | 5g |
$1000 | 2024-08-02 | |
| Alichem | A015023486-250mg |
Methyl 3-cyano-2-methylbenzoate |
93340-09-1 | 97% | 250mg |
$494.40 | 2023-08-31 | |
| Alichem | A015023486-500mg |
Methyl 3-cyano-2-methylbenzoate |
93340-09-1 | 97% | 500mg |
$839.45 | 2023-08-31 | |
| Alichem | A015023486-1g |
Methyl 3-cyano-2-methylbenzoate |
93340-09-1 | 97% | 1g |
$1475.10 | 2023-08-31 |
Methyl 3-cyano-2-methylbenzoate Production Method
Production Method 1
Production Method 2
- Preparation of indenoisoquinolinone analogs as inhibitors of poly(ADP-ribose) polymerase, World Intellectual Property Organization, , ,
Production Method 3
- Synthesis of tropane derivatives for pharmaceutical use, World Intellectual Property Organization, , ,
Production Method 4
- Preparation of substituted pyrazolopyrimidines as antagonists of the adenosine A2a receptor, World Intellectual Property Organization, , ,
Production Method 5
- Preparation of quinoline derivatives as antiallergics and antiinflammatories, World Intellectual Property Organization, , ,
Production Method 6
- The oxazoline-benzyne route to 1,2,3-trisubstituted benzenes. Tandem addition of organolithiums, organocuprates, and α-lithionitriles to benzynesPansegrau, Paul D.; Rieker, William F.; Meyers, A. I., Journal of the American Chemical Society, 1988, 110(21), 7178-84
Production Method 7
1.2 Reagents: Sodium bicarbonate Solvents: Water
- Late-stage Pd-catalyzed Cyanations of Aryl/Heteroaryl Halides in Aqueous Micellar MediaThakore, Ruchita R.; Takale, Balaram S. ; Singhania, Vani; Gallou, Fabrice; Lipshutz, Bruce H., ChemCatChem, 2021, 13(1), 212-216
Production Method 8
- Preparation of oxoindoline derivatives as protein function modulators, World Intellectual Property Organization, , ,
Production Method 9
1.2 -
- Tandem addition-rearrangement of nitrile anions to benzyne. A convenient synthesis of 3-cyano-2-alkylbenzoic acids and benzaldehydesMeyers, A. I.; Pansegrau, Paul D., Tetrahedron Letters, 1984, 25(28), 2941-4
Production Method 10
- Metabotropic glutamate receptor positive allosteric modulators and uses thereof, World Intellectual Property Organization, , ,
Methyl 3-cyano-2-methylbenzoate Raw materials
- Potassium Ferrocyanide Trihydrate
- Benzonitrile, 3-(4,5-dihydro-4,4-dimethyl-2-oxazolyl)-2-methyl-
- Potassium hexacyanoferrate
- Potassium Hexacyanoferrate(III)
- Methyl 3-bromo-2-methylbenzoate
- Methyl 3-iodo-2-methylbenzoate
Methyl 3-cyano-2-methylbenzoate Preparation Products
Methyl 3-cyano-2-methylbenzoate Related Literature
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
Additional information on Methyl 3-cyano-2-methylbenzoate
Comprehensive Overview of Methyl 3-cyano-2-methylbenzoate (CAS No. 93340-09-1): Properties, Applications, and Industry Insights
Methyl 3-cyano-2-methylbenzoate (CAS No. 93340-09-1) is a specialized organic compound widely recognized for its versatile applications in pharmaceuticals, agrochemicals, and fine chemical synthesis. This ester derivative, featuring a cyano group and a methyl ester moiety, has garnered significant attention due to its role as a key intermediate in the synthesis of complex molecules. Its molecular structure, C10H9NO2, combines reactivity and stability, making it a valuable building block in modern chemical research.
In recent years, the demand for high-purity Methyl 3-cyano-2-methylbenzoate has surged, driven by advancements in drug discovery and crop protection technologies. Researchers frequently search for "synthesis methods for Methyl 3-cyano-2-methylbenzoate" or "CAS 93340-09-1 suppliers," reflecting its commercial and scientific relevance. The compound's unique electron-withdrawing cyano group enhances its utility in nucleophilic substitution reactions, a topic often explored in academic forums and patent literature.
From an industrial perspective, Methyl 3-cyano-2-methylbenzoate is pivotal in the production of active pharmaceutical ingredients (APIs). Its incorporation into heterocyclic frameworks aligns with trends in targeted therapy and personalized medicine, addressing global health challenges. Environmental considerations also play a role, as manufacturers seek "green synthesis routes for 93340-09-1" to reduce waste and energy consumption—a response to the growing emphasis on sustainable chemistry.
Analytical techniques such as HPLC and GC-MS are commonly employed to ensure the purity of CAS 93340-09-1, particularly for regulatory compliance in GMP-certified facilities. Discussions around "spectroscopic data of Methyl 3-cyano-2-methylbenzoate" frequently appear in scientific databases, underscoring the need for precise characterization. Additionally, its solubility profiles and thermal stability are critical parameters for formulation scientists optimizing drug delivery systems.
Emerging applications of Methyl 3-cyano-2-methylbenzoate extend to material science, where it serves as a precursor for functional polymers and liquid crystals. Innovations in flexible electronics and organic semiconductors have further amplified interest in this compound. Industry reports highlight collaborations between academic institutions and chemical manufacturers to explore "scalable production techniques for 93340-09-1," ensuring cost-effectiveness without compromising quality.
In conclusion, Methyl 3-cyano-2-methylbenzoate (CAS No. 93340-09-1) exemplifies the intersection of chemistry and technology. Its multifaceted roles—from pharmaceutical intermediates to advanced materials—reflect the compound's adaptability to evolving scientific and industrial needs. As research continues to uncover new potentials, this molecule remains a cornerstone in innovation-driven sectors.
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