Dichloromethyl phenyl ether
TL;DR: Dichloromethyl phenyl ether (CAS 54518-15-9) is a chemical compound with molecular formula C7H6Cl2O and molecular weight 175.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dichloromethoxybenzene
Also Known As: benzene, (Dichloromethoxy)benzene, dichloromethyl phenyl ether, dichlorophenoxymethane, DICHLOROMETHOXYBENZENE
| Molecular Formula | C7H6Cl2O |
|---|---|
| Molecular Weight | 175.98 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.97957 |
| Heavy Atoms | 10 |
| Complexity | 89.0 |
Chemical Identifiers
| CAS Number | 54518-15-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC(Cl)Cl |
| InChIKey | JFCMAIACBGBZRX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dichloromethyl phenyl ether (CAS 54518-15-9), with molecular formula C7H6Cl2O and molecular weight 175.98 g/mol. IUPAC: dichloromethoxybenzene.
Chemical Property Profile of Dichloromethyl phenyl ether
Property Insights of Dichloromethyl phenyl ether
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dichloromethyl phenyl ether. With a topological polar surface area (TPSA) of 9.2 Ų, Dichloromethyl phenyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dichloromethyl phenyl ether has 0 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 Dichloromethyl phenyl ether?
The CAS number of Dichloromethyl phenyl ether is 54518-15-9.
What is the molecular formula of Dichloromethyl phenyl ether?
The molecular formula of Dichloromethyl phenyl ether is C7H6Cl2O.
What is the molecular weight of Dichloromethyl phenyl ether?
The molecular weight of Dichloromethyl phenyl ether is 175.98 g/mol.
Where can I buy Dichloromethyl phenyl ether?
You can request a quote for Dichloromethyl phenyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dichloromethyl phenyl ether?
Yes, KEHONG BIO provides custom synthesis services for Dichloromethyl phenyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.