1-Chloro-4-(3-chloro-1-methoxypropyl)benzene
TL;DR: 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene (CAS 6630-41-7) 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.
1-chloro-4-(3-chloro-1-methoxypropyl)benzene
Also Known As: 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene, 3-(4-Chlorophenyl)-3-Methoxypropyl Chloride, 3-methoxy-3-(p-chlorophenyl)-1-chloropropane, Benzene,1-chloro-4-(3-chloro-1-methoxypropyl)-, Benzene, 1-chloro-4-(3-chloro-1-methoxypropyl)-
| Molecular Formula | C10H12Cl2O |
|---|---|
| Molecular Weight | 218.03 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 218.02652 |
| Heavy Atoms | 13 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 6630-41-7 |
|---|---|
| SMILES | COC(CCCl)C1=CC=C(C=C1)Cl |
| InChIKey | WEMSZIUGMVBXTP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Chloro-4-(3-chloro-1-methoxypropyl)benzene (CAS 6630-41-7), with molecular formula C10H12Cl2O and molecular weight 218.03 g/mol. IUPAC: 1-chloro-4-(3-chloro-1-methoxypropyl)benzene.
Chemical Property Profile of 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene
Property Insights of 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene
The XLogP value of 3.2 indicates that 1-Chloro-4-(3-chloro-1-methoxypropyl)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, 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-4-(3-chloro-1-methoxypropyl)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 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene?
The CAS number of 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene is 6630-41-7.
What is the molecular formula of 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene?
The molecular formula of 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene is C10H12Cl2O.
What is the molecular weight of 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene?
The molecular weight of 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene is 218.03 g/mol.
Where can I buy 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene?
You can request a quote for 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-4-(3-chloro-1-methoxypropyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.