1,1,1-三氟乙烷
TL;DR: 1,1,1-三氟乙烷 (CAS 420-46-2) is a chemical compound with molecular formula C2H3F3 and molecular weight 84.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1-三氟乙烷
1,1,1-trifluoroethane
Also Known As: 1,1,1-TRIFLUOROETHANE, Methylfluoroform, Trifluoroethane, 1,1,1-Trifluoroform, Fluorocarbon FC143a
| Molecular Formula | C2H3F3 |
|---|---|
| Molecular Weight | 84.02 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 84.018684 |
| Heavy Atoms | 5 |
| Complexity | 26.0 |
| Melting Point | -111.8 °C |
| Boiling Point | -47.20 °C |
| Density | Density: 1.176 g/mL at -50 °C |
| Solubility | Soluble in ethyl ether, chloroform |
| Vapor Pressure | 1262 kPa at 298.165 deg K (9465 mm Hg at 25 °C) |
| Refractive Index | Liquid refractive index: 1.22 at 25 °C |
Chemical Identifiers
| CAS Number | 420-46-2 |
|---|---|
| SMILES | CC(F)(F)F |
| InChIKey | UJPMYEOUBPIPHQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1,1-三氟乙烷 (CAS 420-46-2), with molecular formula C2H3F3 and molecular weight 84.02 g/mol. IUPAC: 1,1,1-trifluoroethane.
Chemical Property Profile of 1,1,1-三氟乙烷
Property Insights of 1,1,1-三氟乙烷
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1,1-三氟乙烷. With a topological polar surface area (TPSA) of 0.0 Ų, 1,1,1-三氟乙烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1-三氟乙烷 has 0 hydrogen bond donor(s) and 3 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 1,1,1-三氟乙烷?
The CAS number of 1,1,1-三氟乙烷 is 420-46-2.
What is the molecular formula of 1,1,1-三氟乙烷?
The molecular formula of 1,1,1-三氟乙烷 is C2H3F3.
What is the molecular weight of 1,1,1-三氟乙烷?
The molecular weight of 1,1,1-三氟乙烷 is 84.02 g/mol.
Where can I buy 1,1,1-三氟乙烷?
You can request a quote for 1,1,1-三氟乙烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,1-三氟乙烷?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1-三氟乙烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.