N-(2,2-Diethoxyethyl)aniline
TL;DR: N-(2,2-Diethoxyethyl)aniline (CAS 22758-34-5) is a chemical compound with molecular formula C12H19NO2 and molecular weight 209.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,2-diethoxyethyl)aniline
Also Known As: N-(2,2-Diethoxyethyl)aniline, Anilinoacetaldehyde diethyl acetal, N-(2,2-diethoxyethyl)benzenamine, (2,2-diethoxyethyl)phenylamine, N-(2,2-Diethoxyethyl)aniline #
| Molecular Formula | C12H19NO2 |
|---|---|
| Molecular Weight | 209.14 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 30.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 209.14159 |
| Heavy Atoms | 15 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 22758-34-5 |
|---|---|
| SMILES | CCOC(CNC1=CC=CC=C1)OCC |
| InChIKey | DHGUGEBXVGPRRD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2,2-Diethoxyethyl)aniline (CAS 22758-34-5), with molecular formula C12H19NO2 and molecular weight 209.14 g/mol. IUPAC: N-(2,2-diethoxyethyl)aniline.
Chemical Property Profile of N-(2,2-Diethoxyethyl)aniline
Property Insights of N-(2,2-Diethoxyethyl)aniline
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,2-Diethoxyethyl)aniline. With a topological polar surface area (TPSA) of 30.5 Ų, N-(2,2-Diethoxyethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2,2-Diethoxyethyl)aniline has 1 hydrogen bond donor(s) and 3 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-(2,2-Diethoxyethyl)aniline?
The CAS number of N-(2,2-Diethoxyethyl)aniline is 22758-34-5.
What is the molecular formula of N-(2,2-Diethoxyethyl)aniline?
The molecular formula of N-(2,2-Diethoxyethyl)aniline is C12H19NO2.
What is the molecular weight of N-(2,2-Diethoxyethyl)aniline?
The molecular weight of N-(2,2-Diethoxyethyl)aniline is 209.14 g/mol.
Where can I buy N-(2,2-Diethoxyethyl)aniline?
You can request a quote for N-(2,2-Diethoxyethyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,2-Diethoxyethyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for N-(2,2-Diethoxyethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.