Ethyl 3-hydroxytridecanoate
TL;DR: Ethyl 3-hydroxytridecanoate (CAS 1073-36-5) is a chemical compound with molecular formula C15H30O3 and molecular weight 258.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-hydroxytridecanoate
Also Known As: Ethyl 3-hydroxytridecanoate, ethyl 3-hydroxy tridecanoate, Tridecanoic acid, 3-hydroxy-, ethyl ester, Ethyl 3-hydroxytridecanoate #, 3-hydroxy-tridecanoic acid ethyl ester
| Molecular Formula | C15H30O3 |
|---|---|
| Molecular Weight | 258.22 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 258.21948 |
| Heavy Atoms | 18 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 1073-36-5 |
|---|---|
| SMILES | CCCCCCCCCCC(CC(=O)OCC)O |
| InChIKey | LOFDGMSAUOHYLH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 3-hydroxytridecanoate (CAS 1073-36-5), with molecular formula C15H30O3 and molecular weight 258.22 g/mol. IUPAC: ethyl 3-hydroxytridecanoate.
Chemical Property Profile of Ethyl 3-hydroxytridecanoate
Property Insights of Ethyl 3-hydroxytridecanoate
The XLogP value of 4.8 indicates that Ethyl 3-hydroxytridecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Ethyl 3-hydroxytridecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-hydroxytridecanoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 3-hydroxytridecanoate?
The CAS number of Ethyl 3-hydroxytridecanoate is 1073-36-5.
What is the molecular formula of Ethyl 3-hydroxytridecanoate?
The molecular formula of Ethyl 3-hydroxytridecanoate is C15H30O3.
What is the molecular weight of Ethyl 3-hydroxytridecanoate?
The molecular weight of Ethyl 3-hydroxytridecanoate is 258.22 g/mol.
Where can I buy Ethyl 3-hydroxytridecanoate?
You can request a quote for Ethyl 3-hydroxytridecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-hydroxytridecanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-hydroxytridecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.