![1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]benzene structure](/static/products/6940/6940-88-1.webp)
1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]benzene
TL;DR: 1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]benzene (CAS 6940-88-1) is a chemical compound with molecular formula C12H16Cl2O and molecular weight 246.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-(3-chloro-1-propan-2-yloxypropyl)benzene
Also Known As: 1-CHLORO-4-[3-CHLORO-1-(1-METHYLETHOXY)PROPYL]BENZENE, 1-chloro-4-[3-chloro-1- propyl]benzene, 1-chloro-4-(3-chloro-1-isopropoxypropyl)benzene, 1-Chloro-4-(3-chloro-1-(1-methylethoxy)propyl)benzene, 1-chloro-4-(3-chloro-1-propan-2-yloxypropyl)benzene
| Molecular Formula | C12H16Cl2O |
|---|---|
| Molecular Weight | 246.06 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 246.05782 |
| Heavy Atoms | 15 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 6940-88-1 |
|---|---|
| SMILES | CC(C)OC(CCCl)C1=CC=C(C=C1)Cl |
| InChIKey | KBQWSWLWXZTIKB-UHFFFAOYSA-N |
Product Overview
1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]benzene (CAS 6940-88-1), with molecular formula C12H16Cl2O and molecular weight 246.06 g/mol. IUPAC: 1-chloro-4-(3-chloro-1-propan-2-yloxypropyl)benzene.
Chemical Property Profile of 1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]benzene
Property Insights of 1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]benzene
The XLogP value of 4.0 indicates that 1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]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-(1-methylethoxy)propyl]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]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-(1-methylethoxy)propyl]benzene?
The CAS number of 1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]benzene is 6940-88-1.
What is the molecular formula of 1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]benzene?
The molecular formula of 1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]benzene is C12H16Cl2O.
What is the molecular weight of 1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]benzene?
The molecular weight of 1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]benzene is 246.06 g/mol.
Where can I buy 1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]benzene?
You can request a quote for 1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]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-(1-methylethoxy)propyl]benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-4-[3-chloro-1-(1-methylethoxy)propyl]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.