1,2,3-Trimethylbenzene
TL;DR: 1,2,3-Trimethylbenzene (CAS 526-73-8) is a chemical compound with molecular formula C9H12 and molecular weight 120.0939 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3-trimethylbenzene
Also Known As: 1,2,3-TRIMETHYLBENZENE, Hemimellitene, Hemellitol, Trimethylbenzene, Hemimellitol
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H12 |
| Molecular Weight | 120.0939 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 120.0939 Da |
| Heavy Atoms | 9 |
| Complexity | 76.0 |
| Melting Point | -25.4 °C |
| Boiling Point | 176.12 °C |
| Density | 0.8944 g/cu cm at 20 °C |
| Flash Point | 44 to 53 °C (closed cup) |
| Vapor Pressure | 1.69 [mmHg] |
| Refractive Index | Index of refraction: 1.5139 at 20 °C/D |
| Solubility | Miscible with ethanol, ether, acetone, benzene, petroleum ether, carbon tetrachloride |
| SMILES | CC1=C(C(=CC=C1)C)C |
| InChIKey | FYGHSUNMUKGBRK-UHFFFAOYSA-N |
Product Description
Applications: 1,2,3-Trimethylbenzene is used in complex organic molecule assembly across discovery and process chemistry, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 1,2,3-Trimethylbenzene (CAS 526-73-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
1,2,3-Trimethylbenzene (CAS 526-73-8) is a organic building block with the molecular formula C9H12 and a molecular weight of 120.09 g/mol. Key physical properties include a density of 0.8944 g/cu cm at 20 °C g/cm³, a solubility: Miscible with ethanol, ether, acetone, benzene, petroleum ether, carbon tetrachloride. It is also known as 1,2,3-TRIMETHYLBENZENE and Hemimellitene.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 1,2,3-Trimethylbenzene
Property Insights of 1,2,3-Trimethylbenzene
The XLogP value of 3.6 indicates that 1,2,3-Trimethylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2,3-Trimethylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3-Trimethylbenzene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,2,3-Trimethylbenzene?
The CAS number of 1,2,3-Trimethylbenzene is 526-73-8.
What is the molecular formula of 1,2,3-Trimethylbenzene?
The molecular formula of 1,2,3-Trimethylbenzene is C9H12.
What is the molecular weight of 1,2,3-Trimethylbenzene?
The molecular weight of 1,2,3-Trimethylbenzene is 120.0939 g/mol.
What are the applications of 1,2,3-Trimethylbenzene?
1,2,3-Trimethylbenzene is used in complex organic molecule assembly across discovery and process chemistry, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 1,2,3-Trimethylbenzene (CAS...
Where can I buy 1,2,3-Trimethylbenzene?
You can request a quote for 1,2,3-Trimethylbenzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2,3-Trimethylbenzene?
Yes, CoreyChem provides custom synthesis services for 1,2,3-Trimethylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.