2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione
TL;DR: 2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione (CAS 274691-35-9) is a chemical compound with molecular formula C15H11ClO3 and molecular weight 274.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-2-ethyl-4-hydroxyphenalene-1,3-dione
Also Known As: 2-chloro-2-ethyl-4-hydroxyphenalene-1,3-dione, 2-chloro-2-ethyl-4-hydroxy-phenalene-1,3-dione, 2-chloro-2-ethyl-4-hydroxy-2,3-dihydro-1H-phenalene-1,3-dione
| Molecular Formula | C15H11ClO3 |
|---|---|
| Molecular Weight | 274.04 g/mol |
| LogP | 3.312 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 274.03967 |
| Heavy Atoms | 19 |
| Complexity | 735.4933 |
Chemical Identifiers
| CAS Number | 274691-35-9 |
|---|---|
| SMILES | CCC1(C(=O)C2=CC=CC3=C2C(=C(C=C3)O)C1=O)Cl |
Product Overview
2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione (CAS 274691-35-9), with molecular formula C15H11ClO3 and molecular weight 274.04 g/mol. IUPAC: 2-chloro-2-ethyl-4-hydroxyphenalene-1,3-dione.
Chemical Property Profile of 2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione
Property Insights of 2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione
The XLogP value of 3.312 indicates that 2-Chloro-2-ethyl-4-hydroxyphenalene-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, 2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-2-ethyl-4-hydroxyphenalene-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 2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione?
The CAS number of 2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione is 274691-35-9.
What is the molecular formula of 2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione?
The molecular formula of 2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione is C15H11ClO3.
What is the molecular weight of 2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione?
The molecular weight of 2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione is 274.04 g/mol.
Where can I buy 2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione?
You can request a quote for 2-Chloro-2-ethyl-4-hydroxyphenalene-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 2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-2-ethyl-4-hydroxyphenalene-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.