3-Fluoro-4-methylphenol
TL;DR: 3-Fluoro-4-methylphenol (CAS 452-78-8) is a chemical compound with molecular formula C7H7FO and molecular weight 126.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-fluoro-4-methylphenol
Also Known As: 3-Fluoro-4-methylphenol, 3-Fluoro-p-cresol, 3-Fluoro-4-methyl-phenol, 2-Fluoro-4-hydroxytoluene, 3-Fluoro-p-toluidine
| Molecular Formula | C7H7FO |
|---|---|
| Molecular Weight | 126.05 g/mol |
| LogP | 1.83972 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 126.048096 |
| Heavy Atoms | 9 |
| Complexity | 220.15617 |
Chemical Identifiers
| CAS Number | 452-78-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)O)F |
Product Overview
3-Fluoro-4-methylphenol (CAS 452-78-8), with molecular formula C7H7FO and molecular weight 126.05 g/mol. IUPAC: 3-fluoro-4-methylphenol.
Chemical Property Profile of 3-Fluoro-4-methylphenol
Property Insights of 3-Fluoro-4-methylphenol
The XLogP value of 1.83972 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Fluoro-4-methylphenol. With a topological polar surface area (TPSA) of 20.23 Ų, 3-Fluoro-4-methylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Fluoro-4-methylphenol has 1 hydrogen bond donor(s) and 1 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 3-Fluoro-4-methylphenol?
The CAS number of 3-Fluoro-4-methylphenol is 452-78-8.
What is the molecular formula of 3-Fluoro-4-methylphenol?
The molecular formula of 3-Fluoro-4-methylphenol is C7H7FO.
What is the molecular weight of 3-Fluoro-4-methylphenol?
The molecular weight of 3-Fluoro-4-methylphenol is 126.05 g/mol.
Where can I buy 3-Fluoro-4-methylphenol?
You can request a quote for 3-Fluoro-4-methylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Fluoro-4-methylphenol?
Yes, KEHONG BIO provides custom synthesis services for 3-Fluoro-4-methylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.