三氟乙酸盐
TL;DR: 三氟乙酸盐 (CAS 14477-72-6) is a chemical compound with molecular formula C2F3O2- and molecular weight 112.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三氟乙酸盐
2,2,2-trifluoroacetate
Also Known As: TRIFLUOROACETATE, Perfluoric acid, 2,2,2-trifluoroacetate, trifloroacetate, trifluoracetate
| Molecular Formula | C2F3O2- |
|---|---|
| Molecular Weight | 112.99 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 40.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 112.98504 |
| Heavy Atoms | 7 |
| Complexity | 77.0 |
Chemical Identifiers
| CAS Number | 14477-72-6 |
|---|---|
| SMILES | C(=O)(C(F)(F)F)[O-] |
| InChIKey | DTQVDTLACAAQTR-UHFFFAOYSA-M |
Product Overview
三氟乙酸盐 (CAS 14477-72-6), with molecular formula C2F3O2- and molecular weight 112.99 g/mol. IUPAC: 2,2,2-trifluoroacetate.
Chemical Property Profile of 三氟乙酸盐
Property Insights of 三氟乙酸盐
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 三氟乙酸盐. With a topological polar surface area (TPSA) of 40.1 Ų, 三氟乙酸盐 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 三氟乙酸盐 has 0 hydrogen bond donor(s) and 5 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 三氟乙酸盐?
The CAS number of 三氟乙酸盐 is 14477-72-6.
What is the molecular formula of 三氟乙酸盐?
The molecular formula of 三氟乙酸盐 is C2F3O2-.
What is the molecular weight of 三氟乙酸盐?
The molecular weight of 三氟乙酸盐 is 112.99 g/mol.
Where can I buy 三氟乙酸盐?
You can request a quote for 三氟乙酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三氟乙酸盐?
Yes, KEHONG BIO provides custom synthesis services for 三氟乙酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.