Methyl Nicotinate
TL;DR: Methyl Nicotinate (CAS 93-60-7) is a chemical compound with molecular formula C7H7NO2 and molecular weight 137.04768 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl pyridine-3-carboxylate
Also Known As: METHYL NICOTINATE, Methylnicotinate, Nikomet, Nicometh, Methyl-nicotinate
Application Areas
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H7NO2 |
| Molecular Weight | 137.04768 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 137.04768 Da |
| Heavy Atoms | 10 |
| Complexity | 125.0 |
| Melting Point | 38-43 |
| Boiling Point | 209 |
| Vapor Pressure | 0.27 [mmHg] |
| Solubility | Soluble |
| SMILES | COC(=O)C1=CN=CC=C1 |
| InChIKey | YNBADRVTZLEFNH-UHFFFAOYSA-N |
Product Description
Applications: Methyl Nicotinate is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Methyl Nicotinate is a pharmaceutical intermediate identified by CAS number 93-60-7 and the molecular formula C7H7NO2 and a molecular weight of 137.05 g/mol. Physically, the compound has a solubility: Soluble. Synonyms include METHYL NICOTINATE and Methylnicotinate.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Methyl Nicotinate
Property Insights of Methyl Nicotinate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl Nicotinate. With a topological polar surface area (TPSA) of 39.2 Ų, Methyl Nicotinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl Nicotinate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl Nicotinate?
The CAS number of Methyl Nicotinate is 93-60-7.
What is the molecular formula of Methyl Nicotinate?
The molecular formula of Methyl Nicotinate is C7H7NO2.
What is the molecular weight of Methyl Nicotinate?
The molecular weight of Methyl Nicotinate is 137.04768 g/mol.
What are the applications of Methyl Nicotinate?
Methyl Nicotinate is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Methyl Nicotinate?
You can request a quote for Methyl Nicotinate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl Nicotinate?
Yes, CoreyChem provides custom synthesis services for Methyl Nicotinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.