2-Phenoxyethyl phenylacetate
TL;DR: 2-Phenoxyethyl phenylacetate (CAS 6952-17-6) is a chemical compound with molecular formula C16H16O3 and molecular weight 256.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenoxyethyl 2-phenylacetate
Also Known As: 2-phenoxyethyl phenylacetate, 2-phenoxyethyl 2-phenylacetate
| Molecular Formula | C16H16O3 |
|---|---|
| Molecular Weight | 256.11 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 256.10995 |
| Heavy Atoms | 19 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 6952-17-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(=O)OCCOC2=CC=CC=C2 |
| InChIKey | RCAWJQNDOGDBON-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Phenoxyethyl phenylacetate (CAS 6952-17-6), with molecular formula C16H16O3 and molecular weight 256.11 g/mol. IUPAC: 2-phenoxyethyl 2-phenylacetate.
Chemical Property Profile of 2-Phenoxyethyl phenylacetate
Property Insights of 2-Phenoxyethyl phenylacetate
The XLogP value of 3.4 indicates that 2-Phenoxyethyl phenylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2-Phenoxyethyl phenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenoxyethyl phenylacetate 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 2-Phenoxyethyl phenylacetate?
The CAS number of 2-Phenoxyethyl phenylacetate is 6952-17-6.
What is the molecular formula of 2-Phenoxyethyl phenylacetate?
The molecular formula of 2-Phenoxyethyl phenylacetate is C16H16O3.
What is the molecular weight of 2-Phenoxyethyl phenylacetate?
The molecular weight of 2-Phenoxyethyl phenylacetate is 256.11 g/mol.
Where can I buy 2-Phenoxyethyl phenylacetate?
You can request a quote for 2-Phenoxyethyl phenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenoxyethyl phenylacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenoxyethyl phenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.