2,2-Difluorosuccinic acid
TL;DR: 2,2-Difluorosuccinic acid (CAS 665-31-6) is a chemical compound with molecular formula C4H4F2O4 and molecular weight 154.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-difluorobutanedioic acid
Also Known As: 2,2-Difluorosuccinic acid, 2,2-difluorobutanedioic acid, 2,2-Difluorosuccinicacid, Butanedioic acid, 2,2-difluoro-, 2,2-difluoro-succinic acid
| Molecular Formula | C4H4F2O4 |
|---|---|
| Molecular Weight | 154.01 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 154.00777 |
| Heavy Atoms | 10 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 665-31-6 |
|---|---|
| SMILES | C(C(=O)O)C(C(=O)O)(F)F |
| InChIKey | ZYLFHISLYSHWRH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-Difluorosuccinic acid (CAS 665-31-6), with molecular formula C4H4F2O4 and molecular weight 154.01 g/mol. IUPAC: 2,2-difluorobutanedioic acid.
Chemical Property Profile of 2,2-Difluorosuccinic acid
Property Insights of 2,2-Difluorosuccinic acid
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Difluorosuccinic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-Difluorosuccinic acid. Following Lipinski's Rule of Five, 2,2-Difluorosuccinic acid has 2 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 2,2-Difluorosuccinic acid?
The CAS number of 2,2-Difluorosuccinic acid is 665-31-6.
What is the molecular formula of 2,2-Difluorosuccinic acid?
The molecular formula of 2,2-Difluorosuccinic acid is C4H4F2O4.
What is the molecular weight of 2,2-Difluorosuccinic acid?
The molecular weight of 2,2-Difluorosuccinic acid is 154.01 g/mol.
Where can I buy 2,2-Difluorosuccinic acid?
You can request a quote for 2,2-Difluorosuccinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Difluorosuccinic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Difluorosuccinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.