![2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol structure](/static/products/313/313272-80-9.png)
2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol
TL;DR: 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol (CAS 313272-80-9) is a chemical compound with molecular formula C16H13FN2O and molecular weight 268.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(3-fluorophenyl)-1H-pyrazol-5-yl]-4-methylphenol
Also Known As: BAS 01121837, 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol, 2-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-4-methylphenol, 2-(5-(3-fluorophenyl)-1H-pyrazol-3-yl)-4-methylphenol, (6E)-6-[5-(3-fluorophenyl)-1,2-dihydropyrazol-3-ylidene]-4-methylcyclohexa-2,4-dien-1-one
| Molecular Formula | C16H13FN2O |
|---|---|
| Molecular Weight | 268.10 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 48.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.1012 |
| Heavy Atoms | 20 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 313272-80-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)O)C2=CC(=NN2)C3=CC(=CC=C3)F |
| InChIKey | ZLOZEHOWNJRPHU-UHFFFAOYSA-N |
Product Overview
2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol (CAS 313272-80-9), with molecular formula C16H13FN2O and molecular weight 268.10 g/mol. IUPAC: 2-[3-(3-fluorophenyl)-1H-pyrazol-5-yl]-4-methylphenol.
Chemical Property Profile of 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol
Property Insights of 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol
The XLogP value of 3.6 indicates that 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.9 Ų, 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol has 2 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-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol?
The CAS number of 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol is 313272-80-9.
What is the molecular formula of 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol?
The molecular formula of 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol is C16H13FN2O.
What is the molecular weight of 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol?
The molecular weight of 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol is 268.10 g/mol.
Where can I buy 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol?
You can request a quote for 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-[5-(3-Fluoro-phenyl)-1H-pyrazol-3-yl]-4-methyl-phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.