![Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one structure](/static/products/6946/69461-92-3.webp)
Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one
TL;DR: Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one (CAS 69461-92-3) is a chemical compound with molecular formula C11H12O and molecular weight 160.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentacyclo[5.4.0.02,6.03,10.05,9]undecan-8-one
Also Known As: starbld0045559, Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one, RCL S18326, pentacyclo[5.4.0.02,6.03,10.05,9]undecan-8-one, methyl 2-aminothiazole-4-acetate hydrochloride
| Molecular Formula | C11H12O |
|---|---|
| Molecular Weight | 160.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 160.08882 |
| Heavy Atoms | 12 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 69461-92-3 |
|---|---|
| SMILES | C1C2C3CC4C2C5C1C3C(=O)C45 |
| InChIKey | XGWUKTZSTPLHEO-UHFFFAOYSA-N |
Product Overview
Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one (CAS 69461-92-3), with molecular formula C11H12O and molecular weight 160.09 g/mol. IUPAC: pentacyclo[5.4.0.02,6.03,10.05,9]undecan-8-one.
Chemical Property Profile of Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one
Property Insights of Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one. With a topological polar surface area (TPSA) of 17.1 Ų, Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-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 Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one?
The CAS number of Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one is 69461-92-3.
What is the molecular formula of Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one?
The molecular formula of Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one is C11H12O.
What is the molecular weight of Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one?
The molecular weight of Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one is 160.09 g/mol.
Where can I buy Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one?
You can request a quote for Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one?
Yes, KEHONG BIO provides custom synthesis services for Pentacyclo[6.3.0.0(2,7).0(4,11).0(5,9)]undecan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.