1-Chloro-4-hydroxyanthraquinone
TL;DR: 1-Chloro-4-hydroxyanthraquinone (CAS 82-42-8) is a chemical compound with molecular formula C14H7ClO3 and molecular weight 258.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-hydroxyanthracene-9,10-dione
Also Known As: 1-Chloro-4-hydroxyanthraquinone, 1-Hydroxy-4-chloroanthraquinone, 1-chloro-4-hydroxyanthracene-9,10-dione, Anthraquinone, 1-chloro-4-hydroxy-, 1-Chlor-4-oxyanthrachinon
| Molecular Formula | C14H7ClO3 |
|---|---|
| Molecular Weight | 258.01 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 258.00836 |
| Heavy Atoms | 18 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 82-42-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)Cl)O |
| InChIKey | TUZZWPYZPHNFJY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Chloro-4-hydroxyanthraquinone (CAS 82-42-8), with molecular formula C14H7ClO3 and molecular weight 258.01 g/mol. IUPAC: 1-chloro-4-hydroxyanthracene-9,10-dione.
Chemical Property Profile of 1-Chloro-4-hydroxyanthraquinone
Property Insights of 1-Chloro-4-hydroxyanthraquinone
The XLogP value of 4.2 indicates that 1-Chloro-4-hydroxyanthraquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 1-Chloro-4-hydroxyanthraquinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-4-hydroxyanthraquinone 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-Chloro-4-hydroxyanthraquinone?
The CAS number of 1-Chloro-4-hydroxyanthraquinone is 82-42-8.
What is the molecular formula of 1-Chloro-4-hydroxyanthraquinone?
The molecular formula of 1-Chloro-4-hydroxyanthraquinone is C14H7ClO3.
What is the molecular weight of 1-Chloro-4-hydroxyanthraquinone?
The molecular weight of 1-Chloro-4-hydroxyanthraquinone is 258.01 g/mol.
Where can I buy 1-Chloro-4-hydroxyanthraquinone?
You can request a quote for 1-Chloro-4-hydroxyanthraquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-4-hydroxyanthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-4-hydroxyanthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.