Benzyl 4-methoxybenzoate
TL;DR: Benzyl 4-methoxybenzoate (CAS 6316-54-7) 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 4-methoxybenzoate
Also Known As: Benzyl anisate, Benzyl 4-methoxybenzoate, benzylanisate, Benzyl p-anisate, benzyl-4-methoxybenzoate
| Molecular Formula | C15H14O3 |
|---|---|
| Molecular Weight | 242.09 g/mol |
| LogP | 3.9 |
| 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 | 250.0 |
Chemical Identifiers
| CAS Number | 6316-54-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)OCC2=CC=CC=C2 |
| InChIKey | SWWYHGZVYNAAHI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzyl 4-methoxybenzoate (CAS 6316-54-7), with molecular formula C15H14O3 and molecular weight 242.09 g/mol. IUPAC: benzyl 4-methoxybenzoate.
Chemical Property Profile of Benzyl 4-methoxybenzoate
Property Insights of Benzyl 4-methoxybenzoate
The XLogP value of 3.9 indicates that Benzyl 4-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 4-methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 4-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 4-methoxybenzoate?
The CAS number of Benzyl 4-methoxybenzoate is 6316-54-7.
What is the molecular formula of Benzyl 4-methoxybenzoate?
The molecular formula of Benzyl 4-methoxybenzoate is C15H14O3.
What is the molecular weight of Benzyl 4-methoxybenzoate?
The molecular weight of Benzyl 4-methoxybenzoate is 242.09 g/mol.
Where can I buy Benzyl 4-methoxybenzoate?
You can request a quote for Benzyl 4-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 4-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 4-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.