2,6-Dimethylphenyl 2-ethoxybenzoate
TL;DR: 2,6-Dimethylphenyl 2-ethoxybenzoate (CAS 448253-98-3) is a chemical compound with molecular formula C17H18O3 and molecular weight 270.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,6-dimethylphenyl) 2-ethoxybenzoate
Also Known As: 2,6-dimethylphenyl 2-ethoxybenzoate, (2,6-dimethylphenyl) 2-ethoxybenzoate, F3096-0694
| Molecular Formula | C17H18O3 |
|---|---|
| Molecular Weight | 270.13 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.12558 |
| Heavy Atoms | 20 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 448253-98-3 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C(=O)OC2=C(C=CC=C2C)C |
| InChIKey | YIGGZZBCBJPTSK-UHFFFAOYSA-N |
Product Overview
2,6-Dimethylphenyl 2-ethoxybenzoate (CAS 448253-98-3), with molecular formula C17H18O3 and molecular weight 270.13 g/mol. IUPAC: (2,6-dimethylphenyl) 2-ethoxybenzoate.
Chemical Property Profile of 2,6-Dimethylphenyl 2-ethoxybenzoate
Property Insights of 2,6-Dimethylphenyl 2-ethoxybenzoate
The XLogP value of 4.4 indicates that 2,6-Dimethylphenyl 2-ethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2,6-Dimethylphenyl 2-ethoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dimethylphenyl 2-ethoxybenzoate 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 2,6-Dimethylphenyl 2-ethoxybenzoate?
The CAS number of 2,6-Dimethylphenyl 2-ethoxybenzoate is 448253-98-3.
What is the molecular formula of 2,6-Dimethylphenyl 2-ethoxybenzoate?
The molecular formula of 2,6-Dimethylphenyl 2-ethoxybenzoate is C17H18O3.
What is the molecular weight of 2,6-Dimethylphenyl 2-ethoxybenzoate?
The molecular weight of 2,6-Dimethylphenyl 2-ethoxybenzoate is 270.13 g/mol.
Where can I buy 2,6-Dimethylphenyl 2-ethoxybenzoate?
You can request a quote for 2,6-Dimethylphenyl 2-ethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dimethylphenyl 2-ethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dimethylphenyl 2-ethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.