![11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid structure](/static/products/948/94891-76-6.png)
11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid
TL;DR: 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid (CAS 94891-76-6) is a chemical compound with molecular formula C12H7NO4 and molecular weight 229.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid
Also Known As: Pyrrolo[2,1,5-cd]indolizine-1,2-dicarboxylic acid
| Molecular Formula | C12H7NO4 |
|---|---|
| Molecular Weight | 229.04 g/mol |
| LogP | 1.9267 |
| Topological Polar Surface Area | 79.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.0375 |
| Heavy Atoms | 17 |
| Complexity | 741.08936 |
Chemical Identifiers
| CAS Number | 94891-76-6 |
|---|---|
| SMILES | C1=CC2=CC=C3N2C(=C1)C(=C3C(=O)O)C(=O)O |
Product Overview
11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid (CAS 94891-76-6), with molecular formula C12H7NO4 and molecular weight 229.04 g/mol. IUPAC: 11-azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid.
Chemical Property Profile of 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid
Property Insights of 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid
The XLogP value of 1.9267 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid. The TPSA of 79.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid. Following Lipinski's Rule of Five, 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-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 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid?
The CAS number of 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid is 94891-76-6.
What is the molecular formula of 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid?
The molecular formula of 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid is C12H7NO4.
What is the molecular weight of 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid?
The molecular weight of 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid is 229.04 g/mol.
Where can I buy 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid?
You can request a quote for 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-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 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 11-Azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.