Ethyl 2-Methoxybenzoate
TL;DR: Ethyl 2-Methoxybenzoate (CAS 7335-26-4) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methoxybenzoate
Also Known As: Ethyl 2-methoxybenzoate, Ethyl o-anisate, Ethyl ortho-anisate, 2-Methoxybenzoic acid ethyl ester, Ethyl o-methoxybenzoate
| Molecular Formula | C10H12O3 |
|---|---|
| Molecular Weight | 180.08 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.07864 |
| Heavy Atoms | 13 |
| Complexity | 168.0 |
Chemical Identifiers
| CAS Number | 7335-26-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=CC=C1OC |
| InChIKey | FNODWEPAWIJGPM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 2-Methoxybenzoate (CAS 7335-26-4), with molecular formula C10H12O3 and molecular weight 180.08 g/mol. IUPAC: ethyl 2-methoxybenzoate.
Chemical Property Profile of Ethyl 2-Methoxybenzoate
Property Insights of Ethyl 2-Methoxybenzoate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-Methoxybenzoate. With a topological polar surface area (TPSA) of 35.5 Ų, Ethyl 2-Methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-Methoxybenzoate 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 Ethyl 2-Methoxybenzoate?
The CAS number of Ethyl 2-Methoxybenzoate is 7335-26-4.
What is the molecular formula of Ethyl 2-Methoxybenzoate?
The molecular formula of Ethyl 2-Methoxybenzoate is C10H12O3.
What is the molecular weight of Ethyl 2-Methoxybenzoate?
The molecular weight of Ethyl 2-Methoxybenzoate is 180.08 g/mol.
Where can I buy Ethyl 2-Methoxybenzoate?
You can request a quote for Ethyl 2-Methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-Methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-Methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.