N-(2,3-Epoxypropyl)-N-ethylaniline
TL;DR: N-(2,3-Epoxypropyl)-N-ethylaniline (CAS 19614-67-6) is a chemical compound with molecular formula C11H15NO and molecular weight 177.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-(oxiran-2-ylmethyl)aniline
Also Known As: n-ethyl-n-(oxiran-2-ylmethyl)aniline, N-Ethyl-N-glycidylaniline, N-(2,3-Epoxypropyl)-N-ethylaniline, ethyl-oxiranylmethyl-phenyl-amine, N-Ethyl-N-phenyloxiranemethanamine
| Molecular Formula | C11H15NO |
|---|---|
| Molecular Weight | 177.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 15.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 177.11537 |
| Heavy Atoms | 13 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 19614-67-6 |
|---|---|
| SMILES | CCN(CC1CO1)C2=CC=CC=C2 |
| InChIKey | VRCFZKKIBKCDQH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2,3-Epoxypropyl)-N-ethylaniline (CAS 19614-67-6), with molecular formula C11H15NO and molecular weight 177.12 g/mol. IUPAC: N-ethyl-N-(oxiran-2-ylmethyl)aniline.
Chemical Property Profile of N-(2,3-Epoxypropyl)-N-ethylaniline
Property Insights of N-(2,3-Epoxypropyl)-N-ethylaniline
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,3-Epoxypropyl)-N-ethylaniline. With a topological polar surface area (TPSA) of 15.8 Ų, N-(2,3-Epoxypropyl)-N-ethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2,3-Epoxypropyl)-N-ethylaniline has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2,3-Epoxypropyl)-N-ethylaniline?
The CAS number of N-(2,3-Epoxypropyl)-N-ethylaniline is 19614-67-6.
What is the molecular formula of N-(2,3-Epoxypropyl)-N-ethylaniline?
The molecular formula of N-(2,3-Epoxypropyl)-N-ethylaniline is C11H15NO.
What is the molecular weight of N-(2,3-Epoxypropyl)-N-ethylaniline?
The molecular weight of N-(2,3-Epoxypropyl)-N-ethylaniline is 177.12 g/mol.
Where can I buy N-(2,3-Epoxypropyl)-N-ethylaniline?
You can request a quote for N-(2,3-Epoxypropyl)-N-ethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,3-Epoxypropyl)-N-ethylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(2,3-Epoxypropyl)-N-ethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.