2,4-Diethoxyaniline
TL;DR: 2,4-Diethoxyaniline (CAS 97-48-3) is a chemical compound with molecular formula C10H15NO2 and molecular weight 181.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-diethoxyaniline
Also Known As: 2,4-Diethoxyaniline, benzenamine, 2,4-diethoxy-, 2,4-diethoxyanilin, Aniline, 2,4-diethoxy-, 2,4-DIETHOXYBENZENAMINE
| Molecular Formula | C10H15NO2 |
|---|---|
| Molecular Weight | 181.11 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 44.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 181.11028 |
| Heavy Atoms | 13 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 97-48-3 |
|---|---|
| SMILES | CCOC1=CC(=C(C=C1)N)OCC |
| InChIKey | RNGRRIYLRPECGA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Diethoxyaniline (CAS 97-48-3), with molecular formula C10H15NO2 and molecular weight 181.11 g/mol. IUPAC: 2,4-diethoxyaniline.
Chemical Property Profile of 2,4-Diethoxyaniline
Property Insights of 2,4-Diethoxyaniline
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Diethoxyaniline. With a topological polar surface area (TPSA) of 44.5 Ų, 2,4-Diethoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Diethoxyaniline 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 2,4-Diethoxyaniline?
The CAS number of 2,4-Diethoxyaniline is 97-48-3.
What is the molecular formula of 2,4-Diethoxyaniline?
The molecular formula of 2,4-Diethoxyaniline is C10H15NO2.
What is the molecular weight of 2,4-Diethoxyaniline?
The molecular weight of 2,4-Diethoxyaniline is 181.11 g/mol.
Where can I buy 2,4-Diethoxyaniline?
You can request a quote for 2,4-Diethoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Diethoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Diethoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.