Methyl 4-(benzyloxy)-3-methoxybenzoate
TL;DR: Methyl 4-(benzyloxy)-3-methoxybenzoate (CAS 56441-97-5) is a chemical compound with molecular formula C16H16O4 and molecular weight 272.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-methoxy-4-phenylmethoxybenzoate
Also Known As: Methyl 4-(benzyloxy)-3-methoxybenzoate, METHYL 4-BENZYLOXY-3-METHOXYBENZOATE, methyl 3-methoxy-4-phenylmethoxybenzoate, 4-Benzyloxy-3-methoxybenzoic Acid Methyl Ester, methyl 4-benzyloxy-3-methoxy-benzoate
| Molecular Formula | C16H16O4 |
|---|---|
| Molecular Weight | 272.10 g/mol |
| LogP | 3.0608 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 272.10486 |
| Heavy Atoms | 20 |
| Complexity | 578.28564 |
Chemical Identifiers
| CAS Number | 56441-97-5 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C(=O)OC)OCC2=CC=CC=C2 |
Product Overview
Methyl 4-(benzyloxy)-3-methoxybenzoate (CAS 56441-97-5), with molecular formula C16H16O4 and molecular weight 272.10 g/mol. IUPAC: methyl 3-methoxy-4-phenylmethoxybenzoate.
Chemical Property Profile of Methyl 4-(benzyloxy)-3-methoxybenzoate
Property Insights of Methyl 4-(benzyloxy)-3-methoxybenzoate
The XLogP value of 3.0608 indicates that Methyl 4-(benzyloxy)-3-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.76 Ų, Methyl 4-(benzyloxy)-3-methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-(benzyloxy)-3-methoxybenzoate has 0 hydrogen bond donor(s) and 4 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 Methyl 4-(benzyloxy)-3-methoxybenzoate?
The CAS number of Methyl 4-(benzyloxy)-3-methoxybenzoate is 56441-97-5.
What is the molecular formula of Methyl 4-(benzyloxy)-3-methoxybenzoate?
The molecular formula of Methyl 4-(benzyloxy)-3-methoxybenzoate is C16H16O4.
What is the molecular weight of Methyl 4-(benzyloxy)-3-methoxybenzoate?
The molecular weight of Methyl 4-(benzyloxy)-3-methoxybenzoate is 272.10 g/mol.
Where can I buy Methyl 4-(benzyloxy)-3-methoxybenzoate?
You can request a quote for Methyl 4-(benzyloxy)-3-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-(benzyloxy)-3-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(benzyloxy)-3-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.