Methyl 4-(benzyloxy)-2-hydroxybenzoate
TL;DR: Methyl 4-(benzyloxy)-2-hydroxybenzoate (CAS 5427-29-2) is a chemical compound with molecular formula C15H14O4 and molecular weight 258.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-hydroxy-4-phenylmethoxybenzoate
Also Known As: methyl 4-(benzyloxy)-2-hydroxybenzoate, methyl 2-hydroxy-4-phenylmethoxybenzoate, methyl 4-benzyloxy-2-hydroxybenzoate, METHYL 2-HYDROXY-4-PHENYLMETHOXY-BENZOATE, Methyl 2-hydroxy-4-benzyloxybenzoate
| Molecular Formula | C15H14O4 |
|---|---|
| Molecular Weight | 258.09 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.0892 |
| Heavy Atoms | 19 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 5427-29-2 |
|---|---|
| SMILES | COC(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)O |
| InChIKey | PHYPTZODBQEMJU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 4-(benzyloxy)-2-hydroxybenzoate (CAS 5427-29-2), with molecular formula C15H14O4 and molecular weight 258.09 g/mol. IUPAC: methyl 2-hydroxy-4-phenylmethoxybenzoate.
Chemical Property Profile of Methyl 4-(benzyloxy)-2-hydroxybenzoate
Property Insights of Methyl 4-(benzyloxy)-2-hydroxybenzoate
The XLogP value of 3.4 indicates that Methyl 4-(benzyloxy)-2-hydroxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, Methyl 4-(benzyloxy)-2-hydroxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-(benzyloxy)-2-hydroxybenzoate has 1 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)-2-hydroxybenzoate?
The CAS number of Methyl 4-(benzyloxy)-2-hydroxybenzoate is 5427-29-2.
What is the molecular formula of Methyl 4-(benzyloxy)-2-hydroxybenzoate?
The molecular formula of Methyl 4-(benzyloxy)-2-hydroxybenzoate is C15H14O4.
What is the molecular weight of Methyl 4-(benzyloxy)-2-hydroxybenzoate?
The molecular weight of Methyl 4-(benzyloxy)-2-hydroxybenzoate is 258.09 g/mol.
Where can I buy Methyl 4-(benzyloxy)-2-hydroxybenzoate?
You can request a quote for Methyl 4-(benzyloxy)-2-hydroxybenzoate 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)-2-hydroxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(benzyloxy)-2-hydroxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.