5-Fluoropyrimidine
TL;DR: 5-Fluoropyrimidine (CAS 675-21-8) is a chemical compound with molecular formula C4H3FN2 and molecular weight 98.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluoropyrimidine
Also Known As: 5-Fluoropyrimidine, Pyrimidine, 5-fluoro-, pyrimidine,5-fluoro, piperidin-2-one, 5-fluoro-pyrimidine
| Molecular Formula | C4H3FN2 |
|---|---|
| Molecular Weight | 98.03 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 98.02802 |
| Heavy Atoms | 7 |
| Complexity | 51.0 |
Chemical Identifiers
| CAS Number | 675-21-8 |
|---|---|
| SMILES | C1=C(C=NC=N1)F |
| InChIKey | KSPDSMOWMQFPBL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Fluoropyrimidine (CAS 675-21-8), with molecular formula C4H3FN2 and molecular weight 98.03 g/mol. IUPAC: 5-fluoropyrimidine.
Chemical Property Profile of 5-Fluoropyrimidine
Property Insights of 5-Fluoropyrimidine
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Fluoropyrimidine. With a topological polar surface area (TPSA) of 25.8 Ų, 5-Fluoropyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Fluoropyrimidine 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 5-Fluoropyrimidine?
The CAS number of 5-Fluoropyrimidine is 675-21-8.
What is the molecular formula of 5-Fluoropyrimidine?
The molecular formula of 5-Fluoropyrimidine is C4H3FN2.
What is the molecular weight of 5-Fluoropyrimidine?
The molecular weight of 5-Fluoropyrimidine is 98.03 g/mol.
Where can I buy 5-Fluoropyrimidine?
You can request a quote for 5-Fluoropyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Fluoropyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 5-Fluoropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.