4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one
TL;DR: 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one (CAS 478043-80-0) is a chemical compound with molecular formula C16H13ClO2 and molecular weight 272.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(3-chlorophenoxy)phenyl]but-3-en-2-one
Also Known As: 4-[2-(3-chlorophenoxy)phenyl]but-3-en-2-one, (E)-4-[2-(3-chlorophenoxy)phenyl]-3-buten-2-one
| Molecular Formula | C16H13ClO2 |
|---|---|
| Molecular Weight | 272.06 g/mol |
| LogP | 4.7345 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.0604 |
| Heavy Atoms | 19 |
| Complexity | 617.65094 |
Chemical Identifiers
| CAS Number | 478043-80-0 |
|---|---|
| SMILES | CC(=O)C=CC1=CC=CC=C1OC2=CC(=CC=C2)Cl |
Product Overview
4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one (CAS 478043-80-0), with molecular formula C16H13ClO2 and molecular weight 272.06 g/mol. IUPAC: 4-[2-(3-chlorophenoxy)phenyl]but-3-en-2-one.
Chemical Property Profile of 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one
Property Insights of 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one
The XLogP value of 4.7345 indicates that 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one has 0 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 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one?
The CAS number of 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one is 478043-80-0.
What is the molecular formula of 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one?
The molecular formula of 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one is C16H13ClO2.
What is the molecular weight of 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one?
The molecular weight of 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one is 272.06 g/mol.
Where can I buy 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one?
You can request a quote for 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-(3-Chlorophenoxy)phenyl]but-3-en-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.