3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde
TL;DR: 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde (CAS 944664-83-9) is a chemical compound with molecular formula C14H20O2 and molecular weight 220.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-tert-butyl-2-ethoxy-5-methylbenzaldehyde
Also Known As: 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde, 3-tert-butyl-2-ethoxy-5-methylbenzaldehyde, 2-ethoxy-5-methyl-3-tert-butyl-benzaldehyde
| Molecular Formula | C14H20O2 |
|---|---|
| Molecular Weight | 220.15 g/mol |
| LogP | 3.50372 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 220.14633 |
| Heavy Atoms | 16 |
| Complexity | 386.45718 |
Chemical Identifiers
| CAS Number | 944664-83-9 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1C(C)(C)C)C)C=O |
Product Overview
3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde (CAS 944664-83-9), with molecular formula C14H20O2 and molecular weight 220.15 g/mol. IUPAC: 3-tert-butyl-2-ethoxy-5-methylbenzaldehyde.
Chemical Property Profile of 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde
Property Insights of 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde
The XLogP value of 3.50372 indicates that 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde 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-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde?
The CAS number of 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde is 944664-83-9.
What is the molecular formula of 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde?
The molecular formula of 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde is C14H20O2.
What is the molecular weight of 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde?
The molecular weight of 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde is 220.15 g/mol.
Where can I buy 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde?
You can request a quote for 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,1-Dimethylethyl)-2-ethoxy-5-methylbenZaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.