Hexafluoroacetone trihydrate
TL;DR: Hexafluoroacetone trihydrate (CAS 34202-69-2) is a chemical compound with molecular formula C3H6F6O4 and molecular weight 220.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1,3,3,3-hexafluoropropan-2-one;trihydrate
Also Known As: Hexafluoroacetone trihydrate, Perfluoroacetone trihydrate, HFA TRIHYDRATE, 1,1,1,3,3,3-hexafluoropropan-2-one trihydrate, Hexafluoroacetone hydrate
| Molecular Formula | C3H6F6O4 |
|---|---|
| Molecular Weight | 220.02 g/mol |
| LogP | -0.79 |
| Topological Polar Surface Area | 20.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 0 |
| Exact Mass | 220.01703 |
| Heavy Atoms | 13 |
| Complexity | 124.0 |
Chemical Identifiers
| CAS Number | 34202-69-2 |
|---|---|
| SMILES | C(=O)(C(F)(F)F)C(F)(F)F.O.O.O |
| InChIKey | SNZAEUWCEHDROX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexafluoroacetone trihydrate (CAS 34202-69-2), with molecular formula C3H6F6O4 and molecular weight 220.02 g/mol. IUPAC: 1,1,1,3,3,3-hexafluoropropan-2-one;trihydrate.
Chemical Property Profile of Hexafluoroacetone trihydrate
Property Insights of Hexafluoroacetone trihydrate
The XLogP value of -0.79 indicates that Hexafluoroacetone trihydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 20.1 Ų, Hexafluoroacetone trihydrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexafluoroacetone trihydrate has 3 hydrogen bond donor(s) and 10 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 Hexafluoroacetone trihydrate?
The CAS number of Hexafluoroacetone trihydrate is 34202-69-2.
What is the molecular formula of Hexafluoroacetone trihydrate?
The molecular formula of Hexafluoroacetone trihydrate is C3H6F6O4.
What is the molecular weight of Hexafluoroacetone trihydrate?
The molecular weight of Hexafluoroacetone trihydrate is 220.02 g/mol.
Where can I buy Hexafluoroacetone trihydrate?
You can request a quote for Hexafluoroacetone trihydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexafluoroacetone trihydrate?
Yes, KEHONG BIO provides custom synthesis services for Hexafluoroacetone trihydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.