Anisyl phenylacetate
TL;DR: Anisyl phenylacetate (CAS 102-17-0) is a chemical compound with molecular formula C16H16O3 and molecular weight 256.10995 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methoxyphenyl)methyl 2-phenylacetate
Also Known As: Anisyl phenylacetate, 4-Methoxybenzyl phenylacetate, Anisyl alpha-toluate, p-Methoxybenzyl phenylacetate, p-Anisyl phenylacetate
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H16O3 |
| Molecular Weight | 256.10995 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 256.10995 Da |
| Heavy Atoms | 19 |
| Complexity | 263.0 |
| Boiling Point | 370.00 °C. @ 760.00 mm Hg |
| Density | 1.125-1.133 |
| Refractive Index | 1.553-1.563 |
| Solubility | insoluble in water; soluble in organic solvents, oils |
| SMILES | COC1=CC=C(C=C1)COC(=O)CC2=CC=CC=C2 |
| InChIKey | VCYWCSZLXMMLLE-UHFFFAOYSA-N |
Product Description
Applications: Anisyl phenylacetate is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Anisyl phenylacetate (CAS 102-17-0) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A heterocyclic building block supplied by CoreyChem, Anisyl phenylacetate (CAS 102-17-0) has the molecular formula C16H16O3 and a molecular weight of 256.11 g/mol. Reported properties include a density of 1.125-1.133 g/cm³, a solubility: insoluble in water; soluble in organic solvents, oils. It is also known as Anisyl phenylacetate and 4-Methoxybenzyl phenylacetate.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Anisyl phenylacetate
Property Insights of Anisyl phenylacetate
The XLogP value of 3.0 indicates that Anisyl 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, Anisyl phenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Anisyl 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
What is the CAS number of Anisyl phenylacetate?
The CAS number of Anisyl phenylacetate is 102-17-0.
What is the molecular formula of Anisyl phenylacetate?
The molecular formula of Anisyl phenylacetate is C16H16O3.
What is the molecular weight of Anisyl phenylacetate?
The molecular weight of Anisyl phenylacetate is 256.10995 g/mol.
What are the applications of Anisyl phenylacetate?
Anisyl phenylacetate is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Anisyl...
Where can I buy Anisyl phenylacetate?
You can request a quote for Anisyl phenylacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Anisyl phenylacetate?
Yes, CoreyChem provides custom synthesis services for Anisyl phenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.