3-Acetylnoradamantane
TL;DR: 3-Acetylnoradamantane (CAS 58275-58-4) is a chemical compound with molecular formula C11H16O and molecular weight 164.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-tricyclo[3.3.1.03,7]nonanyl)ethanone
Also Known As: 3-Acetylnoradamantane, starbld0006904, 3-noradamantyl methyl ketone, 1-(Tricyclo[3.3.1.03,7]non-2-yl)ethanone, 1-{tricyclo[3.3.1.0?,?]nonan-3-yl}ethan-1-one
| Molecular Formula | C11H16O |
|---|---|
| Molecular Weight | 164.12 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 164.12012 |
| Heavy Atoms | 12 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 58275-58-4 |
|---|---|
| SMILES | CC(=O)C12CC3CC(C1)CC2C3 |
| InChIKey | VMCFOTARMDNPPQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Acetylnoradamantane (CAS 58275-58-4), with molecular formula C11H16O and molecular weight 164.12 g/mol. IUPAC: 1-(3-tricyclo[3.3.1.03,7]nonanyl)ethanone.
Chemical Property Profile of 3-Acetylnoradamantane
Property Insights of 3-Acetylnoradamantane
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Acetylnoradamantane. With a topological polar surface area (TPSA) of 17.1 Ų, 3-Acetylnoradamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Acetylnoradamantane 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-Acetylnoradamantane?
The CAS number of 3-Acetylnoradamantane is 58275-58-4.
What is the molecular formula of 3-Acetylnoradamantane?
The molecular formula of 3-Acetylnoradamantane is C11H16O.
What is the molecular weight of 3-Acetylnoradamantane?
The molecular weight of 3-Acetylnoradamantane is 164.12 g/mol.
Where can I buy 3-Acetylnoradamantane?
You can request a quote for 3-Acetylnoradamantane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Acetylnoradamantane?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetylnoradamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.