1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione
TL;DR: 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione (CAS 420825-19-0) is a chemical compound with molecular formula C16H13ClO3 and molecular weight 288.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione
Also Known As: 1-(5-chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione, CHEMBRDG-BB 5813754, CHEMBRDG-BB5813754, 1-(5-Chloro-2-hydroxyphenyl)-3-(m-tolyl)propane-1,3-dione, 1-(5-chloro-2-hydroxyphenyl)-3-(3-methylphenyl)-1,3-propanedione
| Molecular Formula | C16H13ClO3 |
|---|---|
| Molecular Weight | 288.06 g/mol |
| LogP | 3.80972 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.05533 |
| Heavy Atoms | 20 |
| Complexity | 677.17224 |
Chemical Identifiers
| CAS Number | 420825-19-0 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)CC(=O)C2=C(C=CC(=C2)Cl)O |
Product Overview
1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione (CAS 420825-19-0), with molecular formula C16H13ClO3 and molecular weight 288.06 g/mol. IUPAC: 1-(5-chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione.
Chemical Property Profile of 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione
Property Insights of 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione
The XLogP value of 3.80972 indicates that 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.37 Ų, 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione has 1 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 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione?
The CAS number of 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione is 420825-19-0.
What is the molecular formula of 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione?
The molecular formula of 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione is C16H13ClO3.
What is the molecular weight of 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione?
The molecular weight of 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione is 288.06 g/mol.
Where can I buy 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione?
You can request a quote for 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione 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)-3-(3-methylphenyl)propane-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Chloro-2-hydroxyphenyl)-3-(3-methylphenyl)propane-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.