3-Acetyl-2,4,6-trimethylbenzaldehyde
TL;DR: 3-Acetyl-2,4,6-trimethylbenzaldehyde (CAS 88339-43-9) is a chemical compound with molecular formula C12H14O2 and molecular weight 190.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-2,4,6-trimethylbenzaldehyde
Also Known As: 3-acetyl-2,4,6-trimethylbenzaldehyde, CHEMBRDG-BB 5103821, 3-acetyl-2,4,6-trimethyl-benzaldehyde, Benzaldehyde, 3-acetyl-2,4,6-trimethyl-, W-6666
| Molecular Formula | C12H14O2 |
|---|---|
| Molecular Weight | 190.10 g/mol |
| LogP | 2.62696 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 190.09938 |
| Heavy Atoms | 14 |
| Complexity | 403.273 |
Chemical Identifiers
| CAS Number | 88339-43-9 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1C=O)C)C(=O)C)C |
Product Overview
3-Acetyl-2,4,6-trimethylbenzaldehyde (CAS 88339-43-9), with molecular formula C12H14O2 and molecular weight 190.10 g/mol. IUPAC: 3-acetyl-2,4,6-trimethylbenzaldehyde.
Chemical Property Profile of 3-Acetyl-2,4,6-trimethylbenzaldehyde
Property Insights of 3-Acetyl-2,4,6-trimethylbenzaldehyde
The XLogP value of 2.62696 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Acetyl-2,4,6-trimethylbenzaldehyde. With a topological polar surface area (TPSA) of 34.14 Ų, 3-Acetyl-2,4,6-trimethylbenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Acetyl-2,4,6-trimethylbenzaldehyde has 0 hydrogen bond donor(s) and 2 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 3-Acetyl-2,4,6-trimethylbenzaldehyde?
The CAS number of 3-Acetyl-2,4,6-trimethylbenzaldehyde is 88339-43-9.
What is the molecular formula of 3-Acetyl-2,4,6-trimethylbenzaldehyde?
The molecular formula of 3-Acetyl-2,4,6-trimethylbenzaldehyde is C12H14O2.
What is the molecular weight of 3-Acetyl-2,4,6-trimethylbenzaldehyde?
The molecular weight of 3-Acetyl-2,4,6-trimethylbenzaldehyde is 190.10 g/mol.
Where can I buy 3-Acetyl-2,4,6-trimethylbenzaldehyde?
You can request a quote for 3-Acetyl-2,4,6-trimethylbenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Acetyl-2,4,6-trimethylbenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetyl-2,4,6-trimethylbenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.