N,2,6-trimethylaniline
TL;DR: N,2,6-trimethylaniline (CAS 767-71-5) is a chemical compound with molecular formula CC1=C(C(=CC=C1)C)NC and molecular weight 135.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,2,6-trimethylaniline
Also Known As: N,2,6-trimethylaniline, N,2,6-Trimethylbenzenamine, N26-Trimethylaniline, N-methyl-2,6-xylidine, N-methyl-2,6-dimethylaniline
| Molecular Formula | CC1=C(C(=CC=C1)C)NC |
|---|---|
| Molecular Weight | 135.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 135.1048 |
| Heavy Atoms | 10 |
| Complexity | 90.0 |
Chemical Identifiers
| CAS Number | 767-71-5 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC |
| InChIKey | NLGKRVNANIZGNI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,2,6-trimethylaniline (CAS 767-71-5), with molecular formula CC1=C(C(=CC=C1)C)NC and molecular weight 135.10 g/mol. IUPAC: N,2,6-trimethylaniline.
Chemical Property Profile of N,2,6-trimethylaniline
Property Insights of N,2,6-trimethylaniline
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,2,6-trimethylaniline. With a topological polar surface area (TPSA) of 12.0 Ų, N,2,6-trimethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,2,6-trimethylaniline 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 N,2,6-trimethylaniline?
The CAS number of N,2,6-trimethylaniline is 767-71-5.
What is the molecular formula of N,2,6-trimethylaniline?
The molecular formula of N,2,6-trimethylaniline is CC1=C(C(=CC=C1)C)NC.
What is the molecular weight of N,2,6-trimethylaniline?
The molecular weight of N,2,6-trimethylaniline is 135.10 g/mol.
Where can I buy N,2,6-trimethylaniline?
You can request a quote for N,2,6-trimethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,2,6-trimethylaniline?
Yes, KEHONG BIO provides custom synthesis services for N,2,6-trimethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.