Ethyl-10-iododecanoate
TL;DR: Ethyl-10-iododecanoate (CAS 80658-48-6) is a chemical compound with molecular formula CCOC(=O)CCCCCCCCCI and molecular weight 326.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 10-iododecanoate
Also Known As: ethyl 10-iododecanoate, Ethyl-10-iododecanoate, Decanoic acid,10-iodo-, ethyl ester, Decanoic acid, 10-iodo-, ethyl ester, RefChem:139080
| Molecular Formula | CCOC(=O)CCCCCCCCCI |
|---|---|
| Molecular Weight | 326.07 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 326.07428 |
| Heavy Atoms | 15 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 80658-48-6 |
|---|---|
| SMILES | CCOC(=O)CCCCCCCCCI |
| InChIKey | BUPZFVLJNSOVIN-UHFFFAOYSA-N |
Product Overview
Ethyl-10-iododecanoate (CAS 80658-48-6), with molecular formula CCOC(=O)CCCCCCCCCI and molecular weight 326.07 g/mol. IUPAC: ethyl 10-iododecanoate.
Chemical Property Profile of Ethyl-10-iododecanoate
Property Insights of Ethyl-10-iododecanoate
The XLogP value of 5.3 indicates that Ethyl-10-iododecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl-10-iododecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl-10-iododecanoate 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 Ethyl-10-iododecanoate?
The CAS number of Ethyl-10-iododecanoate is 80658-48-6.
What is the molecular formula of Ethyl-10-iododecanoate?
The molecular formula of Ethyl-10-iododecanoate is CCOC(=O)CCCCCCCCCI.
What is the molecular weight of Ethyl-10-iododecanoate?
The molecular weight of Ethyl-10-iododecanoate is 326.07 g/mol.
Where can I buy Ethyl-10-iododecanoate?
You can request a quote for Ethyl-10-iododecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl-10-iododecanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl-10-iododecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.