1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione structure

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

CAS: 134855-60-0
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.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of 1-[3'-Fluoro-4'-(octyloxy)[1,1'-biphenyl]-4-yl]-1,3-butanedione

XLogP
6.3938
TPSA (Topological Polar Surface Area)
43.37
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
12
Heavy Atoms
28
Complexity
780.9373
Exact Mass
384.21008
Monoisotopic Mass
384.21008
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

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

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

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.

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