19-Iodocholesterol 3-ethyl ether
TL;DR: 19-Iodocholesterol 3-ethyl ether (CAS 66277-53-0) is a chemical compound with molecular formula C29H49IO and molecular weight 540.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,8S,9S,10S,13R,14S,17R)-3-ethoxy-10-(iodomethyl)-13-methyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
Also Known As: 19-Iodocholesterol 3-ethyl ether, 3-Ethoxy-19-iodocholest-5-ene, 3beta-Ethoxy-19-iodocholest-5-ene, Cholest-5-ene, 3-ethoxy-19-iodo-, (3beta)-, Germane, bis(2-methoxy-1-naphthalenyl)oxo-
| Molecular Formula | C29H49IO |
|---|---|
| Molecular Weight | 540.28 g/mol |
| LogP | 8.848 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Exact Mass | 540.28284 |
| Heavy Atoms | 31 |
| Complexity | 640.6482 |
Chemical Identifiers
| CAS Number | 66277-53-0 |
|---|---|
| SMILES | CCO[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)CI |
Product Overview
19-Iodocholesterol 3-ethyl ether (CAS 66277-53-0), with molecular formula C29H49IO and molecular weight 540.28 g/mol. IUPAC: (3S,8S,9S,10S,13R,14S,17R)-3-ethoxy-10-(iodomethyl)-13-methyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene.
Chemical Property Profile of 19-Iodocholesterol 3-ethyl ether
Property Insights of 19-Iodocholesterol 3-ethyl ether
The XLogP value of 8.848 indicates that 19-Iodocholesterol 3-ethyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 19-Iodocholesterol 3-ethyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 19-Iodocholesterol 3-ethyl ether has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 19-Iodocholesterol 3-ethyl ether?
The CAS number of 19-Iodocholesterol 3-ethyl ether is 66277-53-0.
What is the molecular formula of 19-Iodocholesterol 3-ethyl ether?
The molecular formula of 19-Iodocholesterol 3-ethyl ether is C29H49IO.
What is the molecular weight of 19-Iodocholesterol 3-ethyl ether?
The molecular weight of 19-Iodocholesterol 3-ethyl ether is 540.28 g/mol.
Where can I buy 19-Iodocholesterol 3-ethyl ether?
You can request a quote for 19-Iodocholesterol 3-ethyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 19-Iodocholesterol 3-ethyl ether?
Yes, KEHONG BIO provides custom synthesis services for 19-Iodocholesterol 3-ethyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.