Cyclopropane-1,1,2-tricarboxylic acid
TL;DR: Cyclopropane-1,1,2-tricarboxylic acid (CAS 90649-82-4) is a chemical compound with molecular formula C6H6O6 and molecular weight 174.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopropane-1,1,2-tricarboxylic acid
Also Known As: cyclopropane-1,1,2-tricarboxylic acid, 1,1,2-Cyclopropantricarbonsaure, 1,1,2-Cyclopropantricarbonsaeure, cyclopropane-1,2-tricarboxylic acid, RefChem:336178
| Molecular Formula | C6H6O6 |
|---|---|
| Molecular Weight | 174.02 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 174.01643 |
| Heavy Atoms | 12 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 90649-82-4 |
|---|---|
| SMILES | C1C(C1(C(=O)O)C(=O)O)C(=O)O |
| InChIKey | YKXAGRCDGMWYRO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclopropane-1,1,2-tricarboxylic acid (CAS 90649-82-4), with molecular formula C6H6O6 and molecular weight 174.02 g/mol. IUPAC: cyclopropane-1,1,2-tricarboxylic acid.
Chemical Property Profile of Cyclopropane-1,1,2-tricarboxylic acid
Property Insights of Cyclopropane-1,1,2-tricarboxylic acid
The XLogP value of -1.0 indicates that Cyclopropane-1,1,2-tricarboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclopropane-1,1,2-tricarboxylic acid. Following Lipinski's Rule of Five, Cyclopropane-1,1,2-tricarboxylic acid has 3 hydrogen bond donor(s) and 6 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 Cyclopropane-1,1,2-tricarboxylic acid?
The CAS number of Cyclopropane-1,1,2-tricarboxylic acid is 90649-82-4.
What is the molecular formula of Cyclopropane-1,1,2-tricarboxylic acid?
The molecular formula of Cyclopropane-1,1,2-tricarboxylic acid is C6H6O6.
What is the molecular weight of Cyclopropane-1,1,2-tricarboxylic acid?
The molecular weight of Cyclopropane-1,1,2-tricarboxylic acid is 174.02 g/mol.
Where can I buy Cyclopropane-1,1,2-tricarboxylic acid?
You can request a quote for Cyclopropane-1,1,2-tricarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopropane-1,1,2-tricarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for Cyclopropane-1,1,2-tricarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.