三氟乙酰氯
TL;DR: 三氟乙酰氯 (CAS 354-32-5) is a chemical compound with molecular formula C2ClF3O and molecular weight 131.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三氟乙酰氯
2,2,2-trifluoroacetyl chloride
Also Known As: Trifluoroacetyl chloride, 2,2,2-trifluoroacetyl chloride, Perfluoroacetyl chloride, TFA chloride, CF3COCl
| Molecular Formula | C2ClF3O |
|---|---|
| Molecular Weight | 131.96 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 131.95898 |
| Heavy Atoms | 7 |
| Complexity | 85.0 |
| Boiling Point | -27 °C |
| Density | 1.384 g/mL at 20 °C |
| Solubility | Exothermic reaction with water to form water soluble trifluoroacetic acid and byproduct HCl. |
| Vapor Pressure | 72 psia at 25 °C (3273 mm Hg) |
Chemical Identifiers
| CAS Number | 354-32-5 |
|---|---|
| SMILES | C(=O)(C(F)(F)F)Cl |
| InChIKey | PNQBEPDZQUOCNY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三氟乙酰氯 (CAS 354-32-5), with molecular formula C2ClF3O and molecular weight 131.96 g/mol. IUPAC: 2,2,2-trifluoroacetyl chloride.
Chemical Property Profile of 三氟乙酰氯
Property Insights of 三氟乙酰氯
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 三氟乙酰氯. With a topological polar surface area (TPSA) of 17.1 Ų, 三氟乙酰氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 三氟乙酰氯 has 0 hydrogen bond donor(s) and 4 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 三氟乙酰氯?
The CAS number of 三氟乙酰氯 is 354-32-5.
What is the molecular formula of 三氟乙酰氯?
The molecular formula of 三氟乙酰氯 is C2ClF3O.
What is the molecular weight of 三氟乙酰氯?
The molecular weight of 三氟乙酰氯 is 131.96 g/mol.
Where can I buy 三氟乙酰氯?
You can request a quote for 三氟乙酰氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三氟乙酰氯?
Yes, KEHONG BIO provides custom synthesis services for 三氟乙酰氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.