2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene
TL;DR: 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene (CAS 32695-20-8) is a chemical compound with molecular formula C10H12Cl2O and molecular weight 218.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4-(chloromethyl)-1-propan-2-yloxybenzene
Also Known As: 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene, 3-Chlor-4-isopropoxy-benzylchlorid, 2-chloro-4-(chloromethyl)-1-isopropoxybenzene, 2-chloro-4-(chloromethyl)-1-propan-2-yloxybenzene, 2-chloro-4-(chloromethyl)-1-(propan-2-yloxy)benzene
| Molecular Formula | C10H12Cl2O |
|---|---|
| Molecular Weight | 218.03 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.02652 |
| Heavy Atoms | 13 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 32695-20-8 |
|---|---|
| SMILES | CC(C)OC1=C(C=C(C=C1)CCl)Cl |
| InChIKey | XZECPLIMOPAQFE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene (CAS 32695-20-8), with molecular formula C10H12Cl2O and molecular weight 218.03 g/mol. IUPAC: 2-chloro-4-(chloromethyl)-1-propan-2-yloxybenzene.
Chemical Property Profile of 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene
Property Insights of 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene
The XLogP value of 3.6 indicates that 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene 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 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene?
The CAS number of 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene is 32695-20-8.
What is the molecular formula of 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene?
The molecular formula of 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene is C10H12Cl2O.
What is the molecular weight of 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene?
The molecular weight of 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene is 218.03 g/mol.
Where can I buy 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene?
You can request a quote for 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-4-(chloromethyl)-1-(1-methylethoxy)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.