2-Oxoadamantan-1-acetic acid
TL;DR: 2-Oxoadamantan-1-acetic acid (CAS 16611-09-9) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-oxo-1-adamantyl)acetic acid
Also Known As: 2-oxoadamantan-1-acetic acid, 2-(2-oxo-1-adamantyl)acetic Acid, 2-(2-oxoadamantan-1-yl)acetic acid, 2-oxo-1-tricyclo[3.3.1.13,7]decanacetic acid
| Molecular Formula | C12H16O3 |
|---|---|
| Molecular Weight | 208.11 g/mol |
| LogP | 1.8565 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.10994 |
| Heavy Atoms | 15 |
| Complexity | 319.75894 |
Chemical Identifiers
| CAS Number | 16611-09-9 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3=O)CC(=O)O |
Product Overview
2-Oxoadamantan-1-acetic acid (CAS 16611-09-9), with molecular formula C12H16O3 and molecular weight 208.11 g/mol. IUPAC: 2-(2-oxo-1-adamantyl)acetic acid.
Chemical Property Profile of 2-Oxoadamantan-1-acetic acid
Property Insights of 2-Oxoadamantan-1-acetic acid
The XLogP value of 1.8565 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxoadamantan-1-acetic acid. With a topological polar surface area (TPSA) of 54.37 Ų, 2-Oxoadamantan-1-acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxoadamantan-1-acetic acid has 1 hydrogen bond donor(s) and 2 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 2-Oxoadamantan-1-acetic acid?
The CAS number of 2-Oxoadamantan-1-acetic acid is 16611-09-9.
What is the molecular formula of 2-Oxoadamantan-1-acetic acid?
The molecular formula of 2-Oxoadamantan-1-acetic acid is C12H16O3.
What is the molecular weight of 2-Oxoadamantan-1-acetic acid?
The molecular weight of 2-Oxoadamantan-1-acetic acid is 208.11 g/mol.
Where can I buy 2-Oxoadamantan-1-acetic acid?
You can request a quote for 2-Oxoadamantan-1-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxoadamantan-1-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxoadamantan-1-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.