4-Benzyloxyphenylacetic acid ethyl ester
TL;DR: 4-Benzyloxyphenylacetic acid ethyl ester (CAS 56441-69-1) is a chemical compound with molecular formula C17H18O3 and molecular weight 270.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(4-phenylmethoxyphenyl)acetate
Also Known As: 4-Benzyloxyphenylacetic acid ethyl ester, Ethyl 2-(4-(benzyloxy)phenyl)acetate, ethyl 2-(4-phenylmethoxyphenyl)acetate, ethyl 4-(benzyloxy)phenylacetate, Ethyl 4-benzyloxyphenylacetate
| Molecular Formula | C17H18O3 |
|---|---|
| Molecular Weight | 270.13 g/mol |
| LogP | 3.3712 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 270.12558 |
| Heavy Atoms | 20 |
| Complexity | 531.9214 |
Chemical Identifiers
| CAS Number | 56441-69-1 |
|---|---|
| SMILES | CCOC(=O)CC1=CC=C(C=C1)OCC2=CC=CC=C2 |
Product Overview
4-Benzyloxyphenylacetic acid ethyl ester (CAS 56441-69-1), with molecular formula C17H18O3 and molecular weight 270.13 g/mol. IUPAC: ethyl 2-(4-phenylmethoxyphenyl)acetate.
Chemical Property Profile of 4-Benzyloxyphenylacetic acid ethyl ester
Property Insights of 4-Benzyloxyphenylacetic acid ethyl ester
The XLogP value of 3.3712 indicates that 4-Benzyloxyphenylacetic acid ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 4-Benzyloxyphenylacetic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzyloxyphenylacetic acid ethyl ester 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 4-Benzyloxyphenylacetic acid ethyl ester?
The CAS number of 4-Benzyloxyphenylacetic acid ethyl ester is 56441-69-1.
What is the molecular formula of 4-Benzyloxyphenylacetic acid ethyl ester?
The molecular formula of 4-Benzyloxyphenylacetic acid ethyl ester is C17H18O3.
What is the molecular weight of 4-Benzyloxyphenylacetic acid ethyl ester?
The molecular weight of 4-Benzyloxyphenylacetic acid ethyl ester is 270.13 g/mol.
Where can I buy 4-Benzyloxyphenylacetic acid ethyl ester?
You can request a quote for 4-Benzyloxyphenylacetic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Benzyloxyphenylacetic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzyloxyphenylacetic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.