1-(5-Chloro-2-hydroxyphenyl)octan-1-one
TL;DR: 1-(5-Chloro-2-hydroxyphenyl)octan-1-one (CAS 52196-48-2) is a chemical compound with molecular formula C14H19ClO2 and molecular weight 254.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-chloro-2-hydroxyphenyl)octan-1-one
Also Known As: 1-(5-chloro-2-hydroxyphenyl)octan-1-one, 1-Octanone, 1-(5-chloro-2-hydroxyphenyl)-, 1-(5-chloro-2-hydroxyphenyl)-1-octanone, 1-Octanone,1-(5-chloro-2-hydroxyphenyl), 1-(5-chloro-2-hydroxy-phenyl)octan-1-one
| Molecular Formula | C14H19ClO2 |
|---|---|
| Molecular Weight | 254.11 g/mol |
| LogP | 4.5888 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 254.10736 |
| Heavy Atoms | 17 |
| Complexity | 374.48502 |
Chemical Identifiers
| CAS Number | 52196-48-2 |
|---|---|
| SMILES | CCCCCCCC(=O)C1=C(C=CC(=C1)Cl)O |
Product Overview
1-(5-Chloro-2-hydroxyphenyl)octan-1-one (CAS 52196-48-2), with molecular formula C14H19ClO2 and molecular weight 254.11 g/mol. IUPAC: 1-(5-chloro-2-hydroxyphenyl)octan-1-one.
Chemical Property Profile of 1-(5-Chloro-2-hydroxyphenyl)octan-1-one
Property Insights of 1-(5-Chloro-2-hydroxyphenyl)octan-1-one
The XLogP value of 4.5888 indicates that 1-(5-Chloro-2-hydroxyphenyl)octan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 1-(5-Chloro-2-hydroxyphenyl)octan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Chloro-2-hydroxyphenyl)octan-1-one 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 1-(5-Chloro-2-hydroxyphenyl)octan-1-one?
The CAS number of 1-(5-Chloro-2-hydroxyphenyl)octan-1-one is 52196-48-2.
What is the molecular formula of 1-(5-Chloro-2-hydroxyphenyl)octan-1-one?
The molecular formula of 1-(5-Chloro-2-hydroxyphenyl)octan-1-one is C14H19ClO2.
What is the molecular weight of 1-(5-Chloro-2-hydroxyphenyl)octan-1-one?
The molecular weight of 1-(5-Chloro-2-hydroxyphenyl)octan-1-one is 254.11 g/mol.
Where can I buy 1-(5-Chloro-2-hydroxyphenyl)octan-1-one?
You can request a quote for 1-(5-Chloro-2-hydroxyphenyl)octan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Chloro-2-hydroxyphenyl)octan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Chloro-2-hydroxyphenyl)octan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.