3-Chloro-o-cresol
TL;DR: 3-Chloro-o-cresol (CAS 3260-87-5) is a chemical compound with molecular formula C7H7ClO and molecular weight 142.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-2-methylphenol
Also Known As: 3-Chloro-2-methylphenol, 3-Chloro-o-cresol, etazolate, 2-Chloro-6-hydroxytoluene, Chlor-o-kresol
| Molecular Formula | C7H7ClO |
|---|---|
| Molecular Weight | 142.02 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 142.01854 |
| Heavy Atoms | 9 |
| Complexity | 94.0 |
Chemical Identifiers
| CAS Number | 3260-87-5 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)O |
| InChIKey | WADQOGCINABPRT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Chloro-o-cresol (CAS 3260-87-5), with molecular formula C7H7ClO and molecular weight 142.02 g/mol. IUPAC: 3-chloro-2-methylphenol.
Chemical Property Profile of 3-Chloro-o-cresol
Property Insights of 3-Chloro-o-cresol
The XLogP value of 3.3 indicates that 3-Chloro-o-cresol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 3-Chloro-o-cresol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-o-cresol 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 3-Chloro-o-cresol?
The CAS number of 3-Chloro-o-cresol is 3260-87-5.
What is the molecular formula of 3-Chloro-o-cresol?
The molecular formula of 3-Chloro-o-cresol is C7H7ClO.
What is the molecular weight of 3-Chloro-o-cresol?
The molecular weight of 3-Chloro-o-cresol is 142.02 g/mol.
Where can I buy 3-Chloro-o-cresol?
You can request a quote for 3-Chloro-o-cresol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-o-cresol?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-o-cresol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.