4-Chloroguaiacol
TL;DR: 4-Chloroguaiacol (CAS 16766-30-6) is a chemical compound with molecular formula C7H7ClO2 and molecular weight 158.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-methoxyphenol
Also Known As: 4-Chloro-2-methoxyphenol, 4-CHLOROGUAIACOL, p-Chloroguaiacol, Phenol, 4-chloro-2-methoxy-, 4-chloro-2-methoxy-phenol
| Molecular Formula | C7H7ClO2 |
|---|---|
| Molecular Weight | 158.01 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 158.01346 |
| Heavy Atoms | 10 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 16766-30-6 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)Cl)O |
| InChIKey | FVZQMMMRFNURSH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloroguaiacol (CAS 16766-30-6), with molecular formula C7H7ClO2 and molecular weight 158.01 g/mol. IUPAC: 4-chloro-2-methoxyphenol.
Chemical Property Profile of 4-Chloroguaiacol
Property Insights of 4-Chloroguaiacol
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloroguaiacol. With a topological polar surface area (TPSA) of 29.5 Ų, 4-Chloroguaiacol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloroguaiacol has 1 hydrogen bond donor(s) and 2 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-Chloroguaiacol?
The CAS number of 4-Chloroguaiacol is 16766-30-6.
What is the molecular formula of 4-Chloroguaiacol?
The molecular formula of 4-Chloroguaiacol is C7H7ClO2.
What is the molecular weight of 4-Chloroguaiacol?
The molecular weight of 4-Chloroguaiacol is 158.01 g/mol.
Where can I buy 4-Chloroguaiacol?
You can request a quote for 4-Chloroguaiacol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloroguaiacol?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloroguaiacol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.