2-Allyl-5-fluorophenol
TL;DR: 2-Allyl-5-fluorophenol (CAS 459432-63-4) is a chemical compound with molecular formula C9H9FO and molecular weight 152.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluoro-2-prop-2-enylphenol
Also Known As: 2-Allyl-5-fluorophenol, 5-fluoro-2-prop-2-enylphenol, Phenol, 5-fluoro-2-(2-propenyl)-, 5-fluoro-2-(prop-2-en-1-yl)phenol, Phenol, 5-fluoro-2-(2-propenyl)- (9CI)
| Molecular Formula | C9H9FO |
|---|---|
| Molecular Weight | 152.06 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 152.06374 |
| Heavy Atoms | 11 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 459432-63-4 |
|---|---|
| SMILES | C=CCC1=C(C=C(C=C1)F)O |
| InChIKey | WUNQTXVVERFOSK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Allyl-5-fluorophenol (CAS 459432-63-4), with molecular formula C9H9FO and molecular weight 152.06 g/mol. IUPAC: 5-fluoro-2-prop-2-enylphenol.
Chemical Property Profile of 2-Allyl-5-fluorophenol
Property Insights of 2-Allyl-5-fluorophenol
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Allyl-5-fluorophenol. With a topological polar surface area (TPSA) of 20.2 Ų, 2-Allyl-5-fluorophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Allyl-5-fluorophenol has 1 hydrogen bond donor(s) and 2 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-Allyl-5-fluorophenol?
The CAS number of 2-Allyl-5-fluorophenol is 459432-63-4.
What is the molecular formula of 2-Allyl-5-fluorophenol?
The molecular formula of 2-Allyl-5-fluorophenol is C9H9FO.
What is the molecular weight of 2-Allyl-5-fluorophenol?
The molecular weight of 2-Allyl-5-fluorophenol is 152.06 g/mol.
Where can I buy 2-Allyl-5-fluorophenol?
You can request a quote for 2-Allyl-5-fluorophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Allyl-5-fluorophenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Allyl-5-fluorophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.