15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one
TL;DR: 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one (CAS 78000-90-5) is a chemical compound with molecular formula C20H31IO2 and molecular weight 430.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15-(1-iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one
Also Known As: 15-iodo-14-hydroxyeicosatrienoicacid,omegalactone
| Molecular Formula | C20H31IO2 |
|---|---|
| Molecular Weight | 430.14 g/mol |
| LogP | 7.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 430.13687 |
| Heavy Atoms | 23 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 78000-90-5 |
|---|---|
| SMILES | CCCCCC(C1CC=CCC=CCC=CCCCC(=O)O1)I |
| InChIKey | FVOPSIYGTPXOLI-UHFFFAOYSA-N |
Product Overview
15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one (CAS 78000-90-5), with molecular formula C20H31IO2 and molecular weight 430.14 g/mol. IUPAC: 15-(1-iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one.
Chemical Property Profile of 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one
Property Insights of 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one
The XLogP value of 7.3 indicates that 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one 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 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one?
The CAS number of 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one is 78000-90-5.
What is the molecular formula of 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one?
The molecular formula of 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one is C20H31IO2.
What is the molecular weight of 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one?
The molecular weight of 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one is 430.14 g/mol.
Where can I buy 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one?
You can request a quote for 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one?
Yes, KEHONG BIO provides custom synthesis services for 15-(1-Iodohexyl)-1-oxacyclopentadeca-6,9,12-trien-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.