4-Chloro-2,5-xylenol
TL;DR: 4-Chloro-2,5-xylenol (CAS 1124-06-7) is a chemical compound with molecular formula C8H9ClO and molecular weight 156.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2,5-dimethylphenol
Also Known As: 4-Chloro-2,5-dimethylphenol, 4-Chloro-2,5-xylenol, Phenol,5-dimethyl-, Phenol,4-chloro-2,5-dimethyl-, 4-chloro-2,5-dimethyl-phenol
| Molecular Formula | C8H9ClO |
|---|---|
| Molecular Weight | 156.03 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 156.0342 |
| Heavy Atoms | 10 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 1124-06-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)C)O |
| InChIKey | MMRJLQJSFOSVAM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-2,5-xylenol (CAS 1124-06-7), with molecular formula C8H9ClO and molecular weight 156.03 g/mol. IUPAC: 4-chloro-2,5-dimethylphenol.
Chemical Property Profile of 4-Chloro-2,5-xylenol
Property Insights of 4-Chloro-2,5-xylenol
The XLogP value of 3.2 indicates that 4-Chloro-2,5-xylenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 4-Chloro-2,5-xylenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-2,5-xylenol has 1 hydrogen bond donor(s) and 1 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-Chloro-2,5-xylenol?
The CAS number of 4-Chloro-2,5-xylenol is 1124-06-7.
What is the molecular formula of 4-Chloro-2,5-xylenol?
The molecular formula of 4-Chloro-2,5-xylenol is C8H9ClO.
What is the molecular weight of 4-Chloro-2,5-xylenol?
The molecular weight of 4-Chloro-2,5-xylenol is 156.03 g/mol.
Where can I buy 4-Chloro-2,5-xylenol?
You can request a quote for 4-Chloro-2,5-xylenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-2,5-xylenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2,5-xylenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.