4-Chloro-2-methylphenol
TL;DR: 4-Chloro-2-methylphenol (CAS 1570-64-5) 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.
4-chloro-2-methylphenol
Also Known As: 4-CHLORO-2-METHYLPHENOL, 4-Chloro-o-cresol, 2-Methyl-4-chlorophenol, 4-Chloro-2-cresol, p-Chloro-o-cresol
| Molecular Formula | C7H7ClO |
|---|---|
| Molecular Weight | 142.02 g/mol |
| LogP | 2.8 |
| 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 |
| Melting Point | 118 to 51.1 °C |
| Boiling Point | 432 to 225.0 °C at 760 mmHg |
| Density | 1.2 g/cu cm |
| Solubility | less than 1 mg/mL at 59 °F (NTP, 1992) |
| Flash Point | greater than 112.8 °C |
| Vapor Pressure | 0.02 [mmHg] |
Chemical Identifiers
| CAS Number | 1570-64-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)O |
| InChIKey | RHPUJHQBPORFGV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-2-methylphenol (CAS 1570-64-5), with molecular formula C7H7ClO and molecular weight 142.02 g/mol. IUPAC: 4-chloro-2-methylphenol.
Chemical Property Profile of 4-Chloro-2-methylphenol
Property Insights of 4-Chloro-2-methylphenol
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-2-methylphenol. With a topological polar surface area (TPSA) of 20.2 Ų, 4-Chloro-2-methylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-2-methylphenol 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-methylphenol?
The CAS number of 4-Chloro-2-methylphenol is 1570-64-5.
What is the molecular formula of 4-Chloro-2-methylphenol?
The molecular formula of 4-Chloro-2-methylphenol is C7H7ClO.
What is the molecular weight of 4-Chloro-2-methylphenol?
The molecular weight of 4-Chloro-2-methylphenol is 142.02 g/mol.
Where can I buy 4-Chloro-2-methylphenol?
You can request a quote for 4-Chloro-2-methylphenol 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-methylphenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-methylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.