Bis(2,2,2-trifluoroethyl)amine
TL;DR: Bis(2,2,2-trifluoroethyl)amine (CAS 407-01-2) is a chemical compound with molecular formula C4H5F6N and molecular weight 181.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoro-N-(2,2,2-trifluoroethyl)ethanamine
Also Known As: Bis(2,2,2-trifluoroethyl)amine, Bis(trifluoroethyl)amine, Bis amine, hexafluoroethylamine, 2,2,2-trifluoro-N-(2,2,2-trifluoroethyl)ethanamine
| Molecular Formula | C4H5F6N |
|---|---|
| Molecular Weight | 181.03 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.03262 |
| Heavy Atoms | 11 |
| Complexity | 98.0 |
Chemical Identifiers
| CAS Number | 407-01-2 |
|---|---|
| SMILES | C(C(F)(F)F)NCC(F)(F)F |
| InChIKey | GTJGHXLFPMOKCE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bis(2,2,2-trifluoroethyl)amine (CAS 407-01-2), with molecular formula C4H5F6N and molecular weight 181.03 g/mol. IUPAC: 2,2,2-trifluoro-N-(2,2,2-trifluoroethyl)ethanamine.
Chemical Property Profile of Bis(2,2,2-trifluoroethyl)amine
Property Insights of Bis(2,2,2-trifluoroethyl)amine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(2,2,2-trifluoroethyl)amine. With a topological polar surface area (TPSA) of 12.0 Ų, Bis(2,2,2-trifluoroethyl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(2,2,2-trifluoroethyl)amine has 1 hydrogen bond donor(s) and 7 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 Bis(2,2,2-trifluoroethyl)amine?
The CAS number of Bis(2,2,2-trifluoroethyl)amine is 407-01-2.
What is the molecular formula of Bis(2,2,2-trifluoroethyl)amine?
The molecular formula of Bis(2,2,2-trifluoroethyl)amine is C4H5F6N.
What is the molecular weight of Bis(2,2,2-trifluoroethyl)amine?
The molecular weight of Bis(2,2,2-trifluoroethyl)amine is 181.03 g/mol.
Where can I buy Bis(2,2,2-trifluoroethyl)amine?
You can request a quote for Bis(2,2,2-trifluoroethyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2,2,2-trifluoroethyl)amine?
Yes, KEHONG BIO provides custom synthesis services for Bis(2,2,2-trifluoroethyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.