2,3,4-Trimethylaniline
TL;DR: 2,3,4-Trimethylaniline (CAS 1467-35-2) is a chemical compound with molecular formula C9H13N and molecular weight 135.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4-trimethylaniline
Also Known As: 2,3,4-Trimethylaniline, Dimethyl-4-toluidine, trimethylphenylamine, Benzenamine, 2,3,4-trimethyl-, Benzenamine, trimethyl-
| Molecular Formula | C9H13N |
|---|---|
| Molecular Weight | 135.10 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 135.1048 |
| Heavy Atoms | 10 |
| Complexity | 111.0 |
Chemical Identifiers
| CAS Number | 1467-35-2 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1)N)C)C |
| InChIKey | RLIPQCDHACHPJW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,4-Trimethylaniline (CAS 1467-35-2), with molecular formula C9H13N and molecular weight 135.10 g/mol. IUPAC: 2,3,4-trimethylaniline.
Chemical Property Profile of 2,3,4-Trimethylaniline
Property Insights of 2,3,4-Trimethylaniline
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,4-Trimethylaniline. With a topological polar surface area (TPSA) of 26.0 Ų, 2,3,4-Trimethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4-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 2,3,4-Trimethylaniline?
The CAS number of 2,3,4-Trimethylaniline is 1467-35-2.
What is the molecular formula of 2,3,4-Trimethylaniline?
The molecular formula of 2,3,4-Trimethylaniline is C9H13N.
What is the molecular weight of 2,3,4-Trimethylaniline?
The molecular weight of 2,3,4-Trimethylaniline is 135.10 g/mol.
Where can I buy 2,3,4-Trimethylaniline?
You can request a quote for 2,3,4-Trimethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4-Trimethylaniline?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4-Trimethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.