2,6-Bis(chloromethyl)-4-methylphenol
TL;DR: 2,6-Bis(chloromethyl)-4-methylphenol (CAS 5862-32-8) is a chemical compound with molecular formula C9H10Cl2O and molecular weight 204.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-bis(chloromethyl)-4-methylphenol
Also Known As: 2,6-Bis(chloromethyl)-4-methylphenol, 2,6-Bis(chloromethyl)-p-cresol, Phenol, 2,6-bis(chloromethyl)-4-methyl-, 2,6-bischloromethyl4-methylphenol, 4-methyl-2,6-dichloromethylphenol
| Molecular Formula | C9H10Cl2O |
|---|---|
| Molecular Weight | 204.01 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.01086 |
| Heavy Atoms | 12 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 5862-32-8 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)CCl)O)CCl |
| InChIKey | NUSAOAJCGJSAIU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-Bis(chloromethyl)-4-methylphenol (CAS 5862-32-8), with molecular formula C9H10Cl2O and molecular weight 204.01 g/mol. IUPAC: 2,6-bis(chloromethyl)-4-methylphenol.
Chemical Property Profile of 2,6-Bis(chloromethyl)-4-methylphenol
Property Insights of 2,6-Bis(chloromethyl)-4-methylphenol
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Bis(chloromethyl)-4-methylphenol. With a topological polar surface area (TPSA) of 20.2 Ų, 2,6-Bis(chloromethyl)-4-methylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Bis(chloromethyl)-4-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 2,6-Bis(chloromethyl)-4-methylphenol?
The CAS number of 2,6-Bis(chloromethyl)-4-methylphenol is 5862-32-8.
What is the molecular formula of 2,6-Bis(chloromethyl)-4-methylphenol?
The molecular formula of 2,6-Bis(chloromethyl)-4-methylphenol is C9H10Cl2O.
What is the molecular weight of 2,6-Bis(chloromethyl)-4-methylphenol?
The molecular weight of 2,6-Bis(chloromethyl)-4-methylphenol is 204.01 g/mol.
Where can I buy 2,6-Bis(chloromethyl)-4-methylphenol?
You can request a quote for 2,6-Bis(chloromethyl)-4-methylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Bis(chloromethyl)-4-methylphenol?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Bis(chloromethyl)-4-methylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.