2-Chloro-5-fluoropyrimidin-4-ol
TL;DR: 2-Chloro-5-fluoropyrimidin-4-ol (CAS 155-12-4) is a chemical compound with molecular formula C4H2ClFN2O and molecular weight 147.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5-fluoro-1H-pyrimidin-6-one
Also Known As: 2-Chloro-4-hydroxy-5-fluoropyrimidine, 2-CHLORO-5-FLUOROPYRIMIDIN-4-ONE, 2-chloro-5-fluoropyrimidin-4(3H)-one, 2-chloro-5-fluoropyrimidin-4-ol, 4-Bromoisoquinoline
| Molecular Formula | C4H2ClFN2O |
|---|---|
| Molecular Weight | 147.98 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 147.98396 |
| Heavy Atoms | 9 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 155-12-4 |
|---|---|
| SMILES | C1=C(C(=O)NC(=N1)Cl)F |
| InChIKey | FHTLMXYURUPWJB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-5-fluoropyrimidin-4-ol (CAS 155-12-4), with molecular formula C4H2ClFN2O and molecular weight 147.98 g/mol. IUPAC: 2-chloro-5-fluoro-1H-pyrimidin-6-one.
Chemical Property Profile of 2-Chloro-5-fluoropyrimidin-4-ol
Property Insights of 2-Chloro-5-fluoropyrimidin-4-ol
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-5-fluoropyrimidin-4-ol. With a topological polar surface area (TPSA) of 41.5 Ų, 2-Chloro-5-fluoropyrimidin-4-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-5-fluoropyrimidin-4-ol has 1 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 2-Chloro-5-fluoropyrimidin-4-ol?
The CAS number of 2-Chloro-5-fluoropyrimidin-4-ol is 155-12-4.
What is the molecular formula of 2-Chloro-5-fluoropyrimidin-4-ol?
The molecular formula of 2-Chloro-5-fluoropyrimidin-4-ol is C4H2ClFN2O.
What is the molecular weight of 2-Chloro-5-fluoropyrimidin-4-ol?
The molecular weight of 2-Chloro-5-fluoropyrimidin-4-ol is 147.98 g/mol.
Where can I buy 2-Chloro-5-fluoropyrimidin-4-ol?
You can request a quote for 2-Chloro-5-fluoropyrimidin-4-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-5-fluoropyrimidin-4-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-5-fluoropyrimidin-4-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.