2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane
TL;DR: 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane (CAS 382-24-1) is a chemical compound with molecular formula C4HF9 and molecular weight 219.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane
Also Known As: Isobutane, perfluoro-, Tris(trifluoromethyl)methane, 1,1,1,3,3,3-Hexafluoro-2-(trifluoromethyl)propane, 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane, Propane, 1,1,1,3,3,3-hexafluoro-2-trifluoromethyl-
| Molecular Formula | C4HF9 |
|---|---|
| Molecular Weight | 219.99 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 0 |
| Exact Mass | 219.99345 |
| Heavy Atoms | 13 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 382-24-1 |
|---|---|
| SMILES | C(C(F)(F)F)(C(F)(F)F)C(F)(F)F |
| InChIKey | IMRLDNHHTCXOOR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane (CAS 382-24-1), with molecular formula C4HF9 and molecular weight 219.99 g/mol. IUPAC: 1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane.
Chemical Property Profile of 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane
Property Insights of 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane
The XLogP value of 3.8 indicates that 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane has 0 hydrogen bond donor(s) and 9 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-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane?
The CAS number of 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane is 382-24-1.
What is the molecular formula of 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane?
The molecular formula of 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane is C4HF9.
What is the molecular weight of 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane?
The molecular weight of 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane is 219.99 g/mol.
Where can I buy 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane?
You can request a quote for 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane?
Yes, KEHONG BIO provides custom synthesis services for 2-(Trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.