Cholesteryl butyl ether
TL;DR: Cholesteryl butyl ether (CAS 10322-03-9) is a chemical compound with molecular formula C31H54O and molecular weight 442.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-butoxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
Also Known As: Cholesteryl butyl ether, 3-butoxycholest-5-ene, cholesterol butyl ether, Tetramethylammoniumtriacetoxyborohydride, 3-butoxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
| Molecular Formula | C31H54O |
|---|---|
| Molecular Weight | 442.42 g/mol |
| LogP | 10.3 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Exact Mass | 442.41748 |
| Heavy Atoms | 32 |
| Complexity | 649.0 |
Chemical Identifiers
| CAS Number | 10322-03-9 |
|---|---|
| SMILES | CCCCOC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C |
| InChIKey | RNIJCNIWUSGVHJ-UHFFFAOYSA-N |
Product Overview
Cholesteryl butyl ether (CAS 10322-03-9), with molecular formula C31H54O and molecular weight 442.42 g/mol. IUPAC: 3-butoxy-10,13-dimethyl-17-(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 Cholesteryl butyl ether
Property Insights of Cholesteryl butyl ether
The XLogP value of 10.3 indicates that Cholesteryl butyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Cholesteryl butyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cholesteryl butyl 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 Cholesteryl butyl ether?
The CAS number of Cholesteryl butyl ether is 10322-03-9.
What is the molecular formula of Cholesteryl butyl ether?
The molecular formula of Cholesteryl butyl ether is C31H54O.
What is the molecular weight of Cholesteryl butyl ether?
The molecular weight of Cholesteryl butyl ether is 442.42 g/mol.
Where can I buy Cholesteryl butyl ether?
You can request a quote for Cholesteryl butyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cholesteryl butyl ether?
Yes, KEHONG BIO provides custom synthesis services for Cholesteryl butyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.