3-Fluoro-4-methoxyphenethyl alcohol
TL;DR: 3-Fluoro-4-methoxyphenethyl alcohol (CAS 404-91-1) is a chemical compound with molecular formula C9H11FO2 and molecular weight 170.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-fluoro-4-methoxyphenyl)ethanol
Also Known As: 3-Fluoro-4-methoxyphenethyl alcohol, 2-(3-fluoro-4-methoxyphenyl)ethanol, Benzeneethanol, 3-fluoro-4-methoxy-, 2-(3-fluoro-4-methoxyphenyl)ethan-1-ol, 3-Fluoro-4-methoxyphenethylAlcohol
| Molecular Formula | C9H11FO2 |
|---|---|
| Molecular Weight | 170.07 g/mol |
| LogP | 1.3691 |
| Topological Polar Surface Area | 29.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.07431 |
| Heavy Atoms | 12 |
| Complexity | 260.70547 |
Chemical Identifiers
| CAS Number | 404-91-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCO)F |
Product Overview
3-Fluoro-4-methoxyphenethyl alcohol (CAS 404-91-1), with molecular formula C9H11FO2 and molecular weight 170.07 g/mol. IUPAC: 2-(3-fluoro-4-methoxyphenyl)ethanol.
Chemical Property Profile of 3-Fluoro-4-methoxyphenethyl alcohol
Property Insights of 3-Fluoro-4-methoxyphenethyl alcohol
The XLogP value of 1.3691 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Fluoro-4-methoxyphenethyl alcohol. With a topological polar surface area (TPSA) of 29.46 Ų, 3-Fluoro-4-methoxyphenethyl alcohol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Fluoro-4-methoxyphenethyl alcohol 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 3-Fluoro-4-methoxyphenethyl alcohol?
The CAS number of 3-Fluoro-4-methoxyphenethyl alcohol is 404-91-1.
What is the molecular formula of 3-Fluoro-4-methoxyphenethyl alcohol?
The molecular formula of 3-Fluoro-4-methoxyphenethyl alcohol is C9H11FO2.
What is the molecular weight of 3-Fluoro-4-methoxyphenethyl alcohol?
The molecular weight of 3-Fluoro-4-methoxyphenethyl alcohol is 170.07 g/mol.
Where can I buy 3-Fluoro-4-methoxyphenethyl alcohol?
You can request a quote for 3-Fluoro-4-methoxyphenethyl alcohol 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-methoxyphenethyl alcohol?
Yes, KEHONG BIO provides custom synthesis services for 3-Fluoro-4-methoxyphenethyl alcohol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.