![(3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid structure](/static/products/7090/70909-78-3.webp)
(3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid
TL;DR: (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid (CAS 70909-78-3) is a chemical compound with molecular formula C9H12O4 and molecular weight 184.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid
Also Known As: (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid, 2-(3-oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid
| Molecular Formula | C9H12O4 |
|---|---|
| Molecular Weight | 184.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 184.07356 |
| Heavy Atoms | 13 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 70909-78-3 |
|---|---|
| SMILES | C1CC2(CCC1OC2=O)CC(=O)O |
| InChIKey | FGYPHAGTLFYFGD-UHFFFAOYSA-N |
Product Overview
(3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid (CAS 70909-78-3), with molecular formula C9H12O4 and molecular weight 184.07 g/mol. IUPAC: 2-(3-oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid.
Chemical Property Profile of (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid
Property Insights of (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid. Following Lipinski's Rule of Five, (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid has 1 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 (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid?
The CAS number of (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid is 70909-78-3.
What is the molecular formula of (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid?
The molecular formula of (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid is C9H12O4.
What is the molecular weight of (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid?
The molecular weight of (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid is 184.07 g/mol.
Where can I buy (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid?
You can request a quote for (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (3-Oxo-2-oxabicyclo[2.2.2]octan-4-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.