2-(2,4,6-Trimethylphenyl)acetaldehyde
TL;DR: 2-(2,4,6-Trimethylphenyl)acetaldehyde (CAS 58047-52-2) is a chemical compound with molecular formula C11H14O and molecular weight 162.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4,6-trimethylphenyl)acetaldehyde
Also Known As: 2-MESITYLACETALDEHYDE, Mesitylacetaldehyde, 2-(2,4,6-trimethylphenyl)acetaldehyde, mesitylacetoaldehyde, 2,4,6-trimethylphenylacetaldehyde
| Molecular Formula | C11H14O |
|---|---|
| Molecular Weight | 162.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 162.10446 |
| Heavy Atoms | 12 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 58047-52-2 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)CC=O)C |
| InChIKey | HXMXUWHNVNPJRR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2,4,6-Trimethylphenyl)acetaldehyde (CAS 58047-52-2), with molecular formula C11H14O and molecular weight 162.10 g/mol. IUPAC: 2-(2,4,6-trimethylphenyl)acetaldehyde.
Chemical Property Profile of 2-(2,4,6-Trimethylphenyl)acetaldehyde
Property Insights of 2-(2,4,6-Trimethylphenyl)acetaldehyde
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,4,6-Trimethylphenyl)acetaldehyde. With a topological polar surface area (TPSA) of 17.1 Ų, 2-(2,4,6-Trimethylphenyl)acetaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,4,6-Trimethylphenyl)acetaldehyde has 0 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-(2,4,6-Trimethylphenyl)acetaldehyde?
The CAS number of 2-(2,4,6-Trimethylphenyl)acetaldehyde is 58047-52-2.
What is the molecular formula of 2-(2,4,6-Trimethylphenyl)acetaldehyde?
The molecular formula of 2-(2,4,6-Trimethylphenyl)acetaldehyde is C11H14O.
What is the molecular weight of 2-(2,4,6-Trimethylphenyl)acetaldehyde?
The molecular weight of 2-(2,4,6-Trimethylphenyl)acetaldehyde is 162.10 g/mol.
Where can I buy 2-(2,4,6-Trimethylphenyl)acetaldehyde?
You can request a quote for 2-(2,4,6-Trimethylphenyl)acetaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,4,6-Trimethylphenyl)acetaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4,6-Trimethylphenyl)acetaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.