Tetradecyl hexanoate
TL;DR: Tetradecyl hexanoate (CAS 7251-21-0) is a chemical compound with molecular formula C20H40O2 and molecular weight 312.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetradecyl hexanoate
Also Known As: Tetradecyl hexanoate, tetradecyl caproate, Tetradecyl hexanoate #, Hexanoic acid, tetradecyl ester, WE(14:0/6:0)
| Molecular Formula | C20H40O2 |
|---|---|
| Molecular Weight | 312.30 g/mol |
| LogP | 8.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Exact Mass | 312.30283 |
| Heavy Atoms | 22 |
| Complexity | 226.0 |
Chemical Identifiers
| CAS Number | 7251-21-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCOC(=O)CCCCC |
| InChIKey | SMMNCBBCUVMKHP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tetradecyl hexanoate (CAS 7251-21-0), with molecular formula C20H40O2 and molecular weight 312.30 g/mol. IUPAC: tetradecyl hexanoate.
Chemical Property Profile of Tetradecyl hexanoate
Property Insights of Tetradecyl hexanoate
The XLogP value of 8.7 indicates that Tetradecyl hexanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Tetradecyl hexanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetradecyl hexanoate 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 Tetradecyl hexanoate?
The CAS number of Tetradecyl hexanoate is 7251-21-0.
What is the molecular formula of Tetradecyl hexanoate?
The molecular formula of Tetradecyl hexanoate is C20H40O2.
What is the molecular weight of Tetradecyl hexanoate?
The molecular weight of Tetradecyl hexanoate is 312.30 g/mol.
Where can I buy Tetradecyl hexanoate?
You can request a quote for Tetradecyl hexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetradecyl hexanoate?
Yes, KEHONG BIO provides custom synthesis services for Tetradecyl hexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.