N-Ethyl-N-benzylaniline
TL;DR: N-Ethyl-N-benzylaniline (CAS 92-59-1) is a chemical compound with molecular formula C15H17N and molecular weight 211.1361 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-benzyl-N-ethylaniline
Also Known As: N-Benzyl-N-ethylaniline, Ethylbenzylaniline, N-ETHYL-N-BENZYLANILINE, N-Ethyl-N-phenylbenzylamine, Benzylethylphenylamine
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H17N |
| Molecular Weight | 211.1361 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 211.1361 Da |
| Heavy Atoms | 16 |
| Complexity | 178.0 |
| Melting Point | 93 to 97 °F (NTP, 1992) |
| Boiling Point | 545 to 547 °F at 760 mmHg (NTP, 1992) |
| Density | 1.034 at 66 °F (NTP, 1992) - Denser than water; will sink |
| Flash Point | greater than 200 °F (NTP, 1992) |
| Vapor Pressure | 0.97 [mmHg] |
| Refractive Index | INDEX OF REFRACTION: 1.5938 AT 23 °C/D |
| Solubility | less than 1 mg/mL at 72 °F (NTP, 1992) |
| SMILES | CCN(CC1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | HSZCJVZRHXPCIA-UHFFFAOYSA-N |
Product Description
Applications: N-Ethyl-N-benzylaniline 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. CoreyChem supplies N-Ethyl-N-benzylaniline (CAS 92-59-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
N-Ethyl-N-benzylaniline (CAS 92-59-1) is a pharmaceutical intermediate with the molecular formula C15H17N and a molecular weight of 211.14 g/mol. Key physical properties include a density of 1.034 at 66 °F (NTP, 1992) - Denser than water; will sink g/cm³, a solubility: less than 1 mg/mL at 72 °F (NTP, 1992). It is also known as N-Benzyl-N-ethylaniline and Ethylbenzylaniline.
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 N-Ethyl-N-benzylaniline
Property Insights of N-Ethyl-N-benzylaniline
The XLogP value of 4.6 indicates that N-Ethyl-N-benzylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, N-Ethyl-N-benzylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Ethyl-N-benzylaniline has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-Ethyl-N-benzylaniline?
The CAS number of N-Ethyl-N-benzylaniline is 92-59-1.
What is the molecular formula of N-Ethyl-N-benzylaniline?
The molecular formula of N-Ethyl-N-benzylaniline is C15H17N.
What is the molecular weight of N-Ethyl-N-benzylaniline?
The molecular weight of N-Ethyl-N-benzylaniline is 211.1361 g/mol.
What are the applications of N-Ethyl-N-benzylaniline?
N-Ethyl-N-benzylaniline 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. CoreyChem supplies N-Ethyl-N-benzylaniline (CAS...
Where can I buy N-Ethyl-N-benzylaniline?
You can request a quote for N-Ethyl-N-benzylaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-Ethyl-N-benzylaniline?
Yes, CoreyChem provides custom synthesis services for N-Ethyl-N-benzylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.