2-Methyl-4-methoxyaniline
TL;DR: 2-Methyl-4-methoxyaniline (CAS 102-50-1) is a chemical compound with molecular formula C8H11NO and molecular weight 137.08406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methoxy-2-methylaniline
Also Known As: 4-Methoxy-2-methylaniline, m-Cresidine, 2-Methyl-4-methoxyaniline, meta-Cresidine, 2-Methyl-p-anisidine
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H11NO |
| Molecular Weight | 137.08406 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 137.08406 Da |
| Heavy Atoms | 10 |
| Complexity | 105.0 |
| Melting Point | 55 to 57 °F (NTP, 1992) |
| Boiling Point | 478 to 480 °F at 760 mmHg (NTP, 1992) |
| Density | 1.065 (NTP, 1992) - Denser than water; will sink |
| Flash Point | greater than 230 °F (NTP, 1992) |
| Vapor Pressure | 0.02 [mmHg] |
| Refractive Index | Index of refraction = 1.5647 @ 20 °C |
| Solubility | less than 1 mg/mL at 70.7 °F (NTP, 1992) |
| SMILES | CC1=C(C=CC(=C1)OC)N |
| InChIKey | CDGNLUSBENXDGG-UHFFFAOYSA-N |
Product Description
Applications: 2-Methyl-4-methoxyaniline is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. 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).
2-Methyl-4-methoxyaniline (CAS 102-50-1) is a heterocyclic building block with the molecular formula C8H11NO and a molecular weight of 137.08 g/mol. Key physical properties include a density of 1.065 (NTP, 1992) - Denser than water; will sink g/cm³, a solubility: less than 1 mg/mL at 70.7 °F (NTP, 1992). Synonyms include 4-Methoxy-2-methylaniline and m-Cresidine.
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 2-Methyl-4-methoxyaniline
Property Insights of 2-Methyl-4-methoxyaniline
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-4-methoxyaniline. With a topological polar surface area (TPSA) of 35.3 Ų, 2-Methyl-4-methoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-4-methoxyaniline has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Methyl-4-methoxyaniline?
The CAS number of 2-Methyl-4-methoxyaniline is 102-50-1.
What is the molecular formula of 2-Methyl-4-methoxyaniline?
The molecular formula of 2-Methyl-4-methoxyaniline is C8H11NO.
What is the molecular weight of 2-Methyl-4-methoxyaniline?
The molecular weight of 2-Methyl-4-methoxyaniline is 137.08406 g/mol.
What are the applications of 2-Methyl-4-methoxyaniline?
2-Methyl-4-methoxyaniline is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item...
Where can I buy 2-Methyl-4-methoxyaniline?
You can request a quote for 2-Methyl-4-methoxyaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methyl-4-methoxyaniline?
Yes, CoreyChem provides custom synthesis services for 2-Methyl-4-methoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.