3-Eudesmen-6-one
TL;DR: 3-Eudesmen-6-one (CAS 56772-20-4) is a chemical compound with molecular formula C15H24O and molecular weight 220.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4a,8-dimethyl-2-propan-2-yl-2,3,4,5,6,8a-hexahydronaphthalen-1-one
Also Known As: Isoacolamone, 3-Eudesmen-6-one, 3-Selinen-6-one, 3,4,4a,5,6,8a-Hexahydro-2-isopropyl-4a,8-dimethyl-1(2H)-naphthalenone, 1(2H)-Naphthalenone, 3,4,4a,5,6,8a-hexahydro-4a,8-dimethyl-2-(1-methylethyl)-
| Molecular Formula | C15H24O |
|---|---|
| Molecular Weight | 220.18 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 220.18271 |
| Heavy Atoms | 16 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 56772-20-4 |
|---|---|
| SMILES | CC1=CCCC2(C1C(=O)C(CC2)C(C)C)C |
| InChIKey | OUIUORSUNABXEN-UHFFFAOYSA-N |
Product Overview
3-Eudesmen-6-one (CAS 56772-20-4), with molecular formula C15H24O and molecular weight 220.18 g/mol. IUPAC: 4a,8-dimethyl-2-propan-2-yl-2,3,4,5,6,8a-hexahydronaphthalen-1-one.
Chemical Property Profile of 3-Eudesmen-6-one
Property Insights of 3-Eudesmen-6-one
The XLogP value of 3.9 indicates that 3-Eudesmen-6-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 3-Eudesmen-6-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Eudesmen-6-one has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Eudesmen-6-one?
The CAS number of 3-Eudesmen-6-one is 56772-20-4.
What is the molecular formula of 3-Eudesmen-6-one?
The molecular formula of 3-Eudesmen-6-one is C15H24O.
What is the molecular weight of 3-Eudesmen-6-one?
The molecular weight of 3-Eudesmen-6-one is 220.18 g/mol.
Where can I buy 3-Eudesmen-6-one?
You can request a quote for 3-Eudesmen-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Eudesmen-6-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Eudesmen-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.