![1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene structure](/static/products/5111/51113-64-5.webp)
1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene
TL;DR: 1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene (CAS 51113-64-5) is a chemical compound with molecular formula C16H23ClO and molecular weight 266.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-(3,7-dimethyloct-6-enoxy)benzene
Also Known As: 1-chloro-4-(3,7-dimethyloct-6-enoxy)benzene, 1-CHLORO-4-[(3,7-DIMETHYLOCT-6-EN-1-YL)OXY]BENZENE
| Molecular Formula | C16H23ClO |
|---|---|
| Molecular Weight | 266.14 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 266.14374 |
| Heavy Atoms | 18 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 51113-64-5 |
|---|---|
| SMILES | CC(CCC=C(C)C)CCOC1=CC=C(C=C1)Cl |
| InChIKey | XTMWJIOAKUBVIF-UHFFFAOYSA-N |
Product Overview
1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene (CAS 51113-64-5), with molecular formula C16H23ClO and molecular weight 266.14 g/mol. IUPAC: 1-chloro-4-(3,7-dimethyloct-6-enoxy)benzene.
Chemical Property Profile of 1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene
Property Insights of 1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene
The XLogP value of 6.2 indicates that 1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]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-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene?
The CAS number of 1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene is 51113-64-5.
What is the molecular formula of 1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene?
The molecular formula of 1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene is C16H23ClO.
What is the molecular weight of 1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene?
The molecular weight of 1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene is 266.14 g/mol.
Where can I buy 1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene?
You can request a quote for 1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]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-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-4-[(3,7-dimethyloct-6-EN-1-YL)oxy]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.