4-Chloro-2-Ethylphenol
TL;DR: 4-Chloro-2-Ethylphenol (CAS 18979-90-3) 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-ethylphenol
Also Known As: 4-Chloro-2-ethylphenol, Phenol, 4-chloro-2-ethyl-, 2-Chloro-4-ethylphenol, 4-Chlor-2-aethylphenol, 4-CHLORO-2-ETHYL-PHENOL
| Molecular Formula | C8H9ClO |
|---|---|
| Molecular Weight | 156.03 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.0342 |
| Heavy Atoms | 10 |
| Complexity | 105.0 |
Chemical Identifiers
| CAS Number | 18979-90-3 |
|---|---|
| SMILES | CCC1=C(C=CC(=C1)Cl)O |
| InChIKey | QCEDDUSMBLCRNH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-2-Ethylphenol (CAS 18979-90-3), with molecular formula C8H9ClO and molecular weight 156.03 g/mol. IUPAC: 4-chloro-2-ethylphenol.
Chemical Property Profile of 4-Chloro-2-Ethylphenol
Property Insights of 4-Chloro-2-Ethylphenol
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-2-Ethylphenol. With a topological polar surface area (TPSA) of 20.2 Ų, 4-Chloro-2-Ethylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-2-Ethylphenol 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-Ethylphenol?
The CAS number of 4-Chloro-2-Ethylphenol is 18979-90-3.
What is the molecular formula of 4-Chloro-2-Ethylphenol?
The molecular formula of 4-Chloro-2-Ethylphenol is C8H9ClO.
What is the molecular weight of 4-Chloro-2-Ethylphenol?
The molecular weight of 4-Chloro-2-Ethylphenol is 156.03 g/mol.
Where can I buy 4-Chloro-2-Ethylphenol?
You can request a quote for 4-Chloro-2-Ethylphenol 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-Ethylphenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-Ethylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.