3,3-Dichloro-1,2-cyclopropanedicarboxylic acid
TL;DR: 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid (CAS 69405-97-6) is a chemical compound with molecular formula C5H4Cl2O4 and molecular weight 197.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dichlorocyclopropane-1,2-dicarboxylic acid
Also Known As: 3,3-dichlorocyclopropane-1,2-dicarboxylic Acid, 3,3-dichloro-1,2-cyclopropanedicarboxylic acid, 3,3-dichloro-cyclopropane-1,2-dicarboxylic acid
| Molecular Formula | C5H4Cl2O4 |
|---|---|
| Molecular Weight | 197.95 g/mol |
| LogP | 0.5755 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 197.94867 |
| Heavy Atoms | 11 |
| Complexity | 202.52231 |
Chemical Identifiers
| CAS Number | 69405-97-6 |
|---|---|
| SMILES | C1(C(C1(Cl)Cl)C(=O)O)C(=O)O |
Product Overview
3,3-Dichloro-1,2-cyclopropanedicarboxylic acid (CAS 69405-97-6), with molecular formula C5H4Cl2O4 and molecular weight 197.95 g/mol. IUPAC: 3,3-dichlorocyclopropane-1,2-dicarboxylic acid.
Chemical Property Profile of 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid
Property Insights of 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid
The XLogP value of 0.5755 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid. Following Lipinski's Rule of Five, 3,3-Dichloro-1,2-cyclopropanedicarboxylic 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 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid?
The CAS number of 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid is 69405-97-6.
What is the molecular formula of 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid?
The molecular formula of 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid is C5H4Cl2O4.
What is the molecular weight of 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid?
The molecular weight of 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid is 197.95 g/mol.
Where can I buy 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid?
You can request a quote for 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dichloro-1,2-cyclopropanedicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.