3-Chloro-2,6-diethylaniline
TL;DR: 3-Chloro-2,6-diethylaniline (CAS 67330-62-5) is a chemical compound with molecular formula C10H14ClN and molecular weight 183.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-2,6-diethylaniline
Also Known As: 3-Chloro-2,6-diethylaniline, Benzenamine, 3-chloro-2,6-diethyl-, 3-chloro,2,6-diethylaniline, 2,6-diethyl-3-chloro-aniline, 3-chloro-2,6-diethyl-aniline
| Molecular Formula | C10H14ClN |
|---|---|
| Molecular Weight | 183.08 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.08148 |
| Heavy Atoms | 12 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 67330-62-5 |
|---|---|
| SMILES | CCC1=C(C(=C(C=C1)Cl)CC)N |
| InChIKey | VDJBIPLKIGSVRG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Chloro-2,6-diethylaniline (CAS 67330-62-5), with molecular formula C10H14ClN and molecular weight 183.08 g/mol. IUPAC: 3-chloro-2,6-diethylaniline.
Chemical Property Profile of 3-Chloro-2,6-diethylaniline
Property Insights of 3-Chloro-2,6-diethylaniline
The XLogP value of 3.5 indicates that 3-Chloro-2,6-diethylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 3-Chloro-2,6-diethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-2,6-diethylaniline has 1 hydrogen bond donor(s) and 1 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 3-Chloro-2,6-diethylaniline?
The CAS number of 3-Chloro-2,6-diethylaniline is 67330-62-5.
What is the molecular formula of 3-Chloro-2,6-diethylaniline?
The molecular formula of 3-Chloro-2,6-diethylaniline is C10H14ClN.
What is the molecular weight of 3-Chloro-2,6-diethylaniline?
The molecular weight of 3-Chloro-2,6-diethylaniline is 183.08 g/mol.
Where can I buy 3-Chloro-2,6-diethylaniline?
You can request a quote for 3-Chloro-2,6-diethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-2,6-diethylaniline?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-2,6-diethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.