13-Tetradecen-1-yl acetate
TL;DR: 13-Tetradecen-1-yl acetate (CAS 56221-91-1) is a chemical compound with molecular formula C16H30O2 and molecular weight 254.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetradec-13-enyl acetate
Also Known As: 13-Tetradecenyl acetate, 13-Tetradecen-1-ol acetate, tetradec-13-enyl acetate, 13-Tetradecen-1-yl acetate, 13-Tetradecenyl acetate #
| Molecular Formula | C16H30O2 |
|---|---|
| Molecular Weight | 254.22 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 254.22458 |
| Heavy Atoms | 18 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 56221-91-1 |
|---|---|
| SMILES | CC(=O)OCCCCCCCCCCCCC=C |
| InChIKey | DZXBZPMJYIXTTI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
13-Tetradecen-1-yl acetate (CAS 56221-91-1), with molecular formula C16H30O2 and molecular weight 254.22 g/mol. IUPAC: tetradec-13-enyl acetate.
Chemical Property Profile of 13-Tetradecen-1-yl acetate
Property Insights of 13-Tetradecen-1-yl acetate
The XLogP value of 6.1 indicates that 13-Tetradecen-1-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 13-Tetradecen-1-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 13-Tetradecen-1-yl acetate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 13-Tetradecen-1-yl acetate?
The CAS number of 13-Tetradecen-1-yl acetate is 56221-91-1.
What is the molecular formula of 13-Tetradecen-1-yl acetate?
The molecular formula of 13-Tetradecen-1-yl acetate is C16H30O2.
What is the molecular weight of 13-Tetradecen-1-yl acetate?
The molecular weight of 13-Tetradecen-1-yl acetate is 254.22 g/mol.
Where can I buy 13-Tetradecen-1-yl acetate?
You can request a quote for 13-Tetradecen-1-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 13-Tetradecen-1-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 13-Tetradecen-1-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.