Phenethyl nonanoate
TL;DR: Phenethyl nonanoate (CAS 57943-67-6) is a chemical compound with molecular formula C17H26O2 and molecular weight 262.19327 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-phenylethyl nonanoate
Also Known As: Phenethyl nonanoate, 2-Phenylethyl nonanoate, phenylethyl nonanoate, Phenylethyl n-nonanoate, 2-Phenylethyl nonanoate #
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H26O2 |
| Molecular Weight | 262.19327 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 262.19327 Da |
| Heavy Atoms | 19 |
| Complexity | 219.0 |
| SMILES | CCCCCCCCC(=O)OCCC1=CC=CC=C1 |
| InChIKey | AFBMLGHBGGLHOF-UHFFFAOYSA-N |
Chemical Property Profile of Phenethyl nonanoate
Property Insights of Phenethyl nonanoate
The XLogP value of 5.6 indicates that Phenethyl nonanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Phenethyl nonanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenethyl nonanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Phenethyl nonanoate?
The CAS number of Phenethyl nonanoate is 57943-67-6.
What is the molecular formula of Phenethyl nonanoate?
The molecular formula of Phenethyl nonanoate is C17H26O2.
What is the molecular weight of Phenethyl nonanoate?
The molecular weight of Phenethyl nonanoate is 262.19327 g/mol.
Where can I buy Phenethyl nonanoate?
You can request a quote for Phenethyl nonanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phenethyl nonanoate?
Yes, CoreyChem provides custom synthesis services for Phenethyl nonanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.