1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione
TL;DR: 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione (CAS 134855-60-0) is a chemical compound with molecular formula C24H29FO3 and molecular weight 384.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(3-fluoro-4-octoxyphenyl)phenyl]butane-1,3-dione
Also Known As: 1-[3'-fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione, AA-516/33242051, 1-[4-(3-fluoro-4-octoxyphenyl)phenyl]butane-1,3-dione, 1-(3'-Fluoro-4'-octyloxy-biphenyl-4-yl)-butane-1,3-dione
| Molecular Formula | C24H29FO3 |
|---|---|
| Molecular Weight | 384.21 g/mol |
| LogP | 6.3938 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 384.21008 |
| Heavy Atoms | 28 |
| Complexity | 780.9373 |
Chemical Identifiers
| CAS Number | 134855-60-0 |
|---|---|
| SMILES | CCCCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)CC(=O)C)F |
Product Overview
1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione (CAS 134855-60-0), with molecular formula C24H29FO3 and molecular weight 384.21 g/mol. IUPAC: 1-[4-(3-fluoro-4-octoxyphenyl)phenyl]butane-1,3-dione.
Chemical Property Profile of 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione
Property Insights of 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione
The XLogP value of 6.3938 indicates that 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione?
The CAS number of 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione is 134855-60-0.
What is the molecular formula of 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione?
The molecular formula of 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione is C24H29FO3.
What is the molecular weight of 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione?
The molecular weight of 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione is 384.21 g/mol.
Where can I buy 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione?
You can request a quote for 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione?
Yes, KEHONG BIO provides custom synthesis services for 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.