Butyl tridecanoate
TL;DR: Butyl tridecanoate (CAS 28267-31-4) is a chemical compound with molecular formula C17H34O2 and molecular weight 270.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl tridecanoate
Also Known As: Butyl tridecanoate, Tridecanoic acid butyl ester, Tridecanoic acid, butylester, Tridecanoic acid, butyl ester, EINECS 248-931-3
| Molecular Formula | C17H34O2 |
|---|---|
| Molecular Weight | 270.26 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 270.2559 |
| Heavy Atoms | 19 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 28267-31-4 |
|---|---|
| SMILES | CCCCCCCCCCCCC(=O)OCCCC |
| InChIKey | HKXBPYQGPDKLHV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyl tridecanoate (CAS 28267-31-4), with molecular formula C17H34O2 and molecular weight 270.26 g/mol. IUPAC: butyl tridecanoate.
Chemical Property Profile of Butyl tridecanoate
Property Insights of Butyl tridecanoate
The XLogP value of 7.1 indicates that Butyl tridecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Butyl tridecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl tridecanoate 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 Butyl tridecanoate?
The CAS number of Butyl tridecanoate is 28267-31-4.
What is the molecular formula of Butyl tridecanoate?
The molecular formula of Butyl tridecanoate is C17H34O2.
What is the molecular weight of Butyl tridecanoate?
The molecular weight of Butyl tridecanoate is 270.26 g/mol.
Where can I buy Butyl tridecanoate?
You can request a quote for Butyl tridecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl tridecanoate?
Yes, KEHONG BIO provides custom synthesis services for Butyl tridecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.