Acetyl ferruginol
TL;DR: Acetyl ferruginol (CAS 15340-79-1) is a chemical compound with molecular formula C22H32O2 and molecular weight 328.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4bS,8aS)-4b,8,8-trimethyl-2-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthren-3-yl] acetate
Also Known As: Acetyl ferruginol, Totarol deriv, Ferruginol acetate, 12-O-Acetylferruginol, 12-Acetoxy-8,11,13-abietatriene
| Molecular Formula | C22H32O2 |
|---|---|
| Molecular Weight | 328.24 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.24023 |
| Heavy Atoms | 24 |
| Complexity | 480.0 |
Chemical Identifiers
| CAS Number | 15340-79-1 |
|---|---|
| SMILES | CC(C)C1=C(C=C2C(=C1)CC[C@@H]3[C@@]2(CCCC3(C)C)C)OC(=O)C |
| InChIKey | AZEPENWNEVUZPW-RBBKRZOGSA-N |
Product Overview
Acetyl ferruginol (CAS 15340-79-1), with molecular formula C22H32O2 and molecular weight 328.24 g/mol. IUPAC: [(4bS,8aS)-4b,8,8-trimethyl-2-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthren-3-yl] acetate.
Chemical Property Profile of Acetyl ferruginol
Property Insights of Acetyl ferruginol
The XLogP value of 6.8 indicates that Acetyl ferruginol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Acetyl ferruginol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetyl ferruginol 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 Acetyl ferruginol?
The CAS number of Acetyl ferruginol is 15340-79-1.
What is the molecular formula of Acetyl ferruginol?
The molecular formula of Acetyl ferruginol is C22H32O2.
What is the molecular weight of Acetyl ferruginol?
The molecular weight of Acetyl ferruginol is 328.24 g/mol.
Where can I buy Acetyl ferruginol?
You can request a quote for Acetyl ferruginol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetyl ferruginol?
Yes, KEHONG BIO provides custom synthesis services for Acetyl ferruginol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.