Tetradecyl benzoate
TL;DR: Tetradecyl benzoate (CAS 70682-72-3) is a chemical compound with molecular formula C21H34O2 and molecular weight 318.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetradecyl benzoate
Also Known As: Tetradecyl benzoate, Myristyl benzoate, tetradecylbenzoate, Benzoic acid n-tetradecyl ester, 1-Tetradecanol, benzoate
| Molecular Formula | C21H34O2 |
|---|---|
| Molecular Weight | 318.26 g/mol |
| LogP | 9.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 318.2559 |
| Heavy Atoms | 23 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 70682-72-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1 |
| InChIKey | YQOBYINWABKLFC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tetradecyl benzoate (CAS 70682-72-3), with molecular formula C21H34O2 and molecular weight 318.26 g/mol. IUPAC: tetradecyl benzoate.
Chemical Property Profile of Tetradecyl benzoate
Property Insights of Tetradecyl benzoate
The XLogP value of 9.0 indicates that Tetradecyl benzoate 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 benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetradecyl benzoate 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 benzoate?
The CAS number of Tetradecyl benzoate is 70682-72-3.
What is the molecular formula of Tetradecyl benzoate?
The molecular formula of Tetradecyl benzoate is C21H34O2.
What is the molecular weight of Tetradecyl benzoate?
The molecular weight of Tetradecyl benzoate is 318.26 g/mol.
Where can I buy Tetradecyl benzoate?
You can request a quote for Tetradecyl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetradecyl benzoate?
Yes, KEHONG BIO provides custom synthesis services for Tetradecyl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.