Benzyl 2-methoxybenzoate
TL;DR: Benzyl 2-methoxybenzoate (CAS 75679-47-9) is a chemical compound with molecular formula C15H14O3 and molecular weight 242.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-methoxybenzoate
Also Known As: Benzyl 2-methoxybenzoate, Benzyl 2-methoxybenzoate #, Benzyl 2-methoxybenzoic acid, 2-Methoxybenzoic acid, benzyl ester, Benzoic acid, 2-methoxy-, phenylmethyl ester
| Molecular Formula | C15H14O3 |
|---|---|
| Molecular Weight | 242.09 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 242.0943 |
| Heavy Atoms | 18 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 75679-47-9 |
|---|---|
| SMILES | COC1=CC=CC=C1C(=O)OCC2=CC=CC=C2 |
| InChIKey | QEQSUVJMTPTKRW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzyl 2-methoxybenzoate (CAS 75679-47-9), with molecular formula C15H14O3 and molecular weight 242.09 g/mol. IUPAC: benzyl 2-methoxybenzoate.
Chemical Property Profile of Benzyl 2-methoxybenzoate
Property Insights of Benzyl 2-methoxybenzoate
The XLogP value of 3.5 indicates that Benzyl 2-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Benzyl 2-methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 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 Benzyl 2-methoxybenzoate?
The CAS number of Benzyl 2-methoxybenzoate is 75679-47-9.
What is the molecular formula of Benzyl 2-methoxybenzoate?
The molecular formula of Benzyl 2-methoxybenzoate is C15H14O3.
What is the molecular weight of Benzyl 2-methoxybenzoate?
The molecular weight of Benzyl 2-methoxybenzoate is 242.09 g/mol.
Where can I buy Benzyl 2-methoxybenzoate?
You can request a quote for Benzyl 2-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 2-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 2-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.