![Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol structure](/static/products/6122/61226-56-0.webp)
Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol
TL;DR: Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol (CAS 61226-56-0) is a chemical compound with molecular formula C18H21NO5 and molecular weight 331.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol
Also Known As: (+-)-3-(6-(2-Propynyl)-6-azabicyclo(3.2.1)oct-1-yl)phenol, Phenol, 3-(6-(2-propynyl)-6-azabicyclo(3.2.1)oct-1-yl)-, (+-)-, ethanedioate (salt), oxalic acid; 3-(7-prop-2-ynyl-7-azabicyclo[3.2.1]octan-5-yl)phenol, Oxalic acid--3-[6-(prop-2-yn-1-yl)-6-azabicyclo[3.2.1]octan-1-yl]phenol (1/1)
| Molecular Formula | C18H21NO5 |
|---|---|
| Molecular Weight | 331.14 g/mol |
| LogP | 1.677 |
| Topological Polar Surface Area | 98.07 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 331.14197 |
| Heavy Atoms | 24 |
| Complexity | 653.6181 |
Chemical Identifiers
| CAS Number | 61226-56-0 |
|---|---|
| SMILES | C#CCN1CC2(CCCC1C2)C3=CC(=CC=C3)O.C(=O)(C(=O)O)O |
Product Overview
Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol (CAS 61226-56-0), with molecular formula C18H21NO5 and molecular weight 331.14 g/mol. IUPAC: oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol.
Chemical Property Profile of Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol
Property Insights of Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol
The XLogP value of 1.677 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol. The TPSA of 98.07 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol. Following Lipinski's Rule of Five, Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol has 3 hydrogen bond donor(s) and 4 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 Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol?
The CAS number of Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol is 61226-56-0.
What is the molecular formula of Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol?
The molecular formula of Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol is C18H21NO5.
What is the molecular weight of Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol?
The molecular weight of Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol is 331.14 g/mol.
Where can I buy Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol?
You can request a quote for Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for Oxalic acid;3-(6-prop-2-ynyl-6-azabicyclo[3.2.1]octan-1-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.