2,4,6-Trifluoropyrimidine
TL;DR: 2,4,6-Trifluoropyrimidine (CAS 696-82-2) is a chemical compound with molecular formula C4HF3N2 and molecular weight 134.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-trifluoropyrimidine
Also Known As: 2,4,6-Trifluoropyrimidine, Pyrimidine, 2,4,6-trifluoro-, 4,5,6-trifluoropyrimidine, 2,4, 6-trifluoropyrimidine, Pyrimidine,2,4,6-trifluoro-
| Molecular Formula | C4HF3N2 |
|---|---|
| Molecular Weight | 134.01 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 134.00919 |
| Heavy Atoms | 9 |
| Complexity | 89.0 |
Chemical Identifiers
| CAS Number | 696-82-2 |
|---|---|
| SMILES | C1=C(N=C(N=C1F)F)F |
| InChIKey | NTSYSQNAPGMSIH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,6-Trifluoropyrimidine (CAS 696-82-2), with molecular formula C4HF3N2 and molecular weight 134.01 g/mol. IUPAC: 2,4,6-trifluoropyrimidine.
Chemical Property Profile of 2,4,6-Trifluoropyrimidine
Property Insights of 2,4,6-Trifluoropyrimidine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,6-Trifluoropyrimidine. With a topological polar surface area (TPSA) of 25.8 Ų, 2,4,6-Trifluoropyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-Trifluoropyrimidine 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 2,4,6-Trifluoropyrimidine?
The CAS number of 2,4,6-Trifluoropyrimidine is 696-82-2.
What is the molecular formula of 2,4,6-Trifluoropyrimidine?
The molecular formula of 2,4,6-Trifluoropyrimidine is C4HF3N2.
What is the molecular weight of 2,4,6-Trifluoropyrimidine?
The molecular weight of 2,4,6-Trifluoropyrimidine is 134.01 g/mol.
Where can I buy 2,4,6-Trifluoropyrimidine?
You can request a quote for 2,4,6-Trifluoropyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Trifluoropyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Trifluoropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.