5-Acetyl-2-ethoxybenzaldehyde
TL;DR: 5-Acetyl-2-ethoxybenzaldehyde (CAS 99865-31-3) is a chemical compound with molecular formula C11H12O3 and molecular weight 192.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetyl-2-ethoxybenzaldehyde
Also Known As: 5-acetyl-2-ethoxybenzaldehyde, 5-acetyl-2-ethoxy-benzaldehyde
| Molecular Formula | C11H12O3 |
|---|---|
| Molecular Weight | 192.08 g/mol |
| LogP | 2.1004 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 192.07864 |
| Heavy Atoms | 14 |
| Complexity | 355.55032 |
Chemical Identifiers
| CAS Number | 99865-31-3 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(=O)C)C=O |
Product Overview
5-Acetyl-2-ethoxybenzaldehyde (CAS 99865-31-3), with molecular formula C11H12O3 and molecular weight 192.08 g/mol. IUPAC: 5-acetyl-2-ethoxybenzaldehyde.
Chemical Property Profile of 5-Acetyl-2-ethoxybenzaldehyde
Property Insights of 5-Acetyl-2-ethoxybenzaldehyde
The XLogP value of 2.1004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Acetyl-2-ethoxybenzaldehyde. With a topological polar surface area (TPSA) of 43.37 Ų, 5-Acetyl-2-ethoxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Acetyl-2-ethoxybenzaldehyde has 0 hydrogen bond donor(s) and 3 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 5-Acetyl-2-ethoxybenzaldehyde?
The CAS number of 5-Acetyl-2-ethoxybenzaldehyde is 99865-31-3.
What is the molecular formula of 5-Acetyl-2-ethoxybenzaldehyde?
The molecular formula of 5-Acetyl-2-ethoxybenzaldehyde is C11H12O3.
What is the molecular weight of 5-Acetyl-2-ethoxybenzaldehyde?
The molecular weight of 5-Acetyl-2-ethoxybenzaldehyde is 192.08 g/mol.
Where can I buy 5-Acetyl-2-ethoxybenzaldehyde?
You can request a quote for 5-Acetyl-2-ethoxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Acetyl-2-ethoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 5-Acetyl-2-ethoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.