![(1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid structure](/static/products/2887/28871-80-9.webp)
(1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid
TL;DR: (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid (CAS 28871-80-9) is a chemical compound with molecular formula C10H12O4 and molecular weight 196.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid
Also Known As: bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid
| Molecular Formula | C10H12O4 |
|---|---|
| Molecular Weight | 196.07 g/mol |
| LogP | 0.984 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.07356 |
| Heavy Atoms | 14 |
| Complexity | 277.24387 |
Chemical Identifiers
| CAS Number | 28871-80-9 |
|---|---|
| SMILES | C1C[C@H]2C=C[C@@H]1[C@H]([C@@H]2C(=O)O)C(=O)O |
Product Overview
(1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid (CAS 28871-80-9), with molecular formula C10H12O4 and molecular weight 196.07 g/mol. IUPAC: (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid.
Chemical Property Profile of (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid
Property Insights of (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid
The XLogP value of 0.984 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid. Following Lipinski's Rule of Five, (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid has 2 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 (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid?
The CAS number of (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid is 28871-80-9.
What is the molecular formula of (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid?
The molecular formula of (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid is C10H12O4.
What is the molecular weight of (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid?
The molecular weight of (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid is 196.07 g/mol.
Where can I buy (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid?
You can request a quote for (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (1S,2R,3R,4R)-bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.