2,4,6-三甲基苯胺
TL;DR: 2,4,6-三甲基苯胺 (CAS 88-05-1) 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.
2,4,6-三甲基苯胺
2,4,6-trimethylaniline
Also Known As: 2,4,6-TRIMETHYLANILINE, Mesidine, Aminomesitylene, Mesitylamine, Mesidin
| 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 | 99.0 |
| Melting Point | -5.0 °C |
| Boiling Point | 450 to 232.8 °C at 760 mmHg |
| Density | 0.9633 - Less dense than water; will float |
| Solubility | Insoluble in water |
| Vapor Pressure | 0.06 [mmHg] |
Chemical Identifiers
| CAS Number | 88-05-1 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)N)C |
| InChIKey | KWVPRPSXBZNOHS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,6-三甲基苯胺 (CAS 88-05-1), with molecular formula C9H13N and molecular weight 135.10 g/mol. IUPAC: 2,4,6-trimethylaniline.
Chemical Property Profile of 2,4,6-三甲基苯胺
Property Insights of 2,4,6-三甲基苯胺
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,6-三甲基苯胺. With a topological polar surface area (TPSA) of 26.0 Ų, 2,4,6-三甲基苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-三甲基苯胺 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 2,4,6-三甲基苯胺?
The CAS number of 2,4,6-三甲基苯胺 is 88-05-1.
What is the molecular formula of 2,4,6-三甲基苯胺?
The molecular formula of 2,4,6-三甲基苯胺 is C9H13N.
What is the molecular weight of 2,4,6-三甲基苯胺?
The molecular weight of 2,4,6-三甲基苯胺 is 135.10 g/mol.
Where can I buy 2,4,6-三甲基苯胺?
You can request a quote for 2,4,6-三甲基苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-三甲基苯胺?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-三甲基苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.