3,3-difluoropentanedioic Acid
TL;DR: 3,3-difluoropentanedioic Acid (CAS 41131-19-5) is a chemical compound with molecular formula C5H6F2O4 and molecular weight 168.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-difluoropentanedioic acid
Also Known As: 3,3-difluoropentanedioic Acid, 3,3-Difluoroglutaric acid, Pentanedioic acid,3,3-difluoro, 3,3-DIFLUOROPENTANEDIOICACID, Pentanedioic acid,3,3-difluoro-
| Molecular Formula | C5H6F2O4 |
|---|---|
| Molecular Weight | 168.02 g/mol |
| LogP | 0.5711 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.02342 |
| Heavy Atoms | 11 |
| Complexity | 159.32123 |
Chemical Identifiers
| CAS Number | 41131-19-5 |
|---|---|
| SMILES | C(C(=O)O)C(CC(=O)O)(F)F |
Product Overview
3,3-difluoropentanedioic Acid (CAS 41131-19-5), with molecular formula C5H6F2O4 and molecular weight 168.02 g/mol. IUPAC: 3,3-difluoropentanedioic acid.
Chemical Property Profile of 3,3-difluoropentanedioic Acid
Property Insights of 3,3-difluoropentanedioic Acid
The XLogP value of 0.5711 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-difluoropentanedioic Acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3-difluoropentanedioic Acid. Following Lipinski's Rule of Five, 3,3-difluoropentanedioic 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-difluoropentanedioic Acid?
The CAS number of 3,3-difluoropentanedioic Acid is 41131-19-5.
What is the molecular formula of 3,3-difluoropentanedioic Acid?
The molecular formula of 3,3-difluoropentanedioic Acid is C5H6F2O4.
What is the molecular weight of 3,3-difluoropentanedioic Acid?
The molecular weight of 3,3-difluoropentanedioic Acid is 168.02 g/mol.
Where can I buy 3,3-difluoropentanedioic Acid?
You can request a quote for 3,3-difluoropentanedioic 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-difluoropentanedioic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3,3-difluoropentanedioic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.