Cinnamyl phenylacetate
TL;DR: Cinnamyl phenylacetate (CAS 133871-04-2) is a chemical compound with molecular formula C17H16O2 and molecular weight 252.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-3-phenylprop-2-enyl] 2-phenylacetate
Also Known As: Cinnamyl phenylacetate, Cinnamyl alpha-toluate, cinnamyl phenyl acetate, Cinnamylalphatoluate, 3-Phenylallyl phenylacetate
| Molecular Formula | C17H16O2 |
|---|---|
| Molecular Weight | 252.12 g/mol |
| LogP | 3.4857 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 252.11504 |
| Heavy Atoms | 19 |
| Complexity | 529.70325 |
Chemical Identifiers
| CAS Number | 133871-04-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(=O)OC/C=C/C2=CC=CC=C2 |
Product Overview
Cinnamyl phenylacetate (CAS 133871-04-2), with molecular formula C17H16O2 and molecular weight 252.12 g/mol. IUPAC: [(E)-3-phenylprop-2-enyl] 2-phenylacetate.
Chemical Property Profile of Cinnamyl phenylacetate
Property Insights of Cinnamyl phenylacetate
The XLogP value of 3.4857 indicates that Cinnamyl phenylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Cinnamyl phenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cinnamyl phenylacetate has 0 hydrogen bond donor(s) and 2 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 Cinnamyl phenylacetate?
The CAS number of Cinnamyl phenylacetate is 133871-04-2.
What is the molecular formula of Cinnamyl phenylacetate?
The molecular formula of Cinnamyl phenylacetate is C17H16O2.
What is the molecular weight of Cinnamyl phenylacetate?
The molecular weight of Cinnamyl phenylacetate is 252.12 g/mol.
Where can I buy Cinnamyl phenylacetate?
You can request a quote for Cinnamyl phenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinnamyl phenylacetate?
Yes, KEHONG BIO provides custom synthesis services for Cinnamyl phenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.