alpha-Fernenol
TL;DR: alpha-Fernenol (CAS 90582-44-8) is a chemical compound with molecular formula C30H50O and molecular weight 426.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3a,5a,8,8,11a,13a-hexamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,7,7a,9,10,11,13,13b-tetradecahydrocyclopenta[a]chrysen-9-ol
Also Known As: Sorghumol, Fernenol, alpha-Fernenol, SodiumOxybate, a-Fernenol
| Molecular Formula | C30H50O |
|---|---|
| Molecular Weight | 426.39 g/mol |
| LogP | 9.0 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 426.38617 |
| Heavy Atoms | 31 |
| Complexity | 777.0 |
Chemical Identifiers
| CAS Number | 90582-44-8 |
|---|---|
| SMILES | CC(C)C1CCC2C1(CCC3(C2(CC=C4C3CCC5C4(CCC(C5(C)C)O)C)C)C)C |
| InChIKey | VWYANPOOORUCFJ-UHFFFAOYSA-N |
Product Overview
alpha-Fernenol (CAS 90582-44-8), with molecular formula C30H50O and molecular weight 426.39 g/mol. IUPAC: 3a,5a,8,8,11a,13a-hexamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,7,7a,9,10,11,13,13b-tetradecahydrocyclopenta[a]chrysen-9-ol.
Chemical Property Profile of alpha-Fernenol
Property Insights of alpha-Fernenol
The XLogP value of 9.0 indicates that alpha-Fernenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, alpha-Fernenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Fernenol has 1 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 alpha-Fernenol?
The CAS number of alpha-Fernenol is 90582-44-8.
What is the molecular formula of alpha-Fernenol?
The molecular formula of alpha-Fernenol is C30H50O.
What is the molecular weight of alpha-Fernenol?
The molecular weight of alpha-Fernenol is 426.39 g/mol.
Where can I buy alpha-Fernenol?
You can request a quote for alpha-Fernenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Fernenol?
Yes, KEHONG BIO provides custom synthesis services for alpha-Fernenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.