![4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate structure](/static/products/4778/477860-05-2.webp)
4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate
TL;DR: 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate (CAS 477860-05-2) is a chemical compound with molecular formula C21H17FO3 and molecular weight 336.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-fluoro-4-(4-phenylmethoxyphenyl)phenyl] acetate
Also Known As: 4'-(benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate, [2-fluoro-4-(4-phenylmethoxyphenyl)phenyl] acetate, 4'-(benzyloxy)-3-fluoro-[1,1'-biphenyl]-4-yl acetate, [4-(4-benzyloxyphenyl)-2-fluoro-phenyl] acetate, 12N-171
| Molecular Formula | C21H17FO3 |
|---|---|
| Molecular Weight | 336.12 g/mol |
| LogP | 4.997 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.11618 |
| Heavy Atoms | 25 |
| Complexity | 858.06946 |
Chemical Identifiers
| CAS Number | 477860-05-2 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1)C2=CC=C(C=C2)OCC3=CC=CC=C3)F |
Product Overview
4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate (CAS 477860-05-2), with molecular formula C21H17FO3 and molecular weight 336.12 g/mol. IUPAC: [2-fluoro-4-(4-phenylmethoxyphenyl)phenyl] acetate.
Chemical Property Profile of 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate
Property Insights of 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate
The XLogP value of 4.997 indicates that 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate has 0 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 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate?
The CAS number of 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate is 477860-05-2.
What is the molecular formula of 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate?
The molecular formula of 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate is C21H17FO3.
What is the molecular weight of 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate?
The molecular weight of 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate is 336.12 g/mol.
Where can I buy 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate?
You can request a quote for 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 4'-(Benzyloxy)-3-fluoro[1,1'-biphenyl]-4-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.