1,1-Dichlorooctane
TL;DR: 1,1-Dichlorooctane (CAS 20395-24-8) is a chemical compound with molecular formula C8H16Cl2 and molecular weight 182.06291 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1-dichlorooctane
Also Known As: 1,1-DICHLOROOCTANE, octane dichloride, 1,1-dichloro-octane, 1,1-dichloro-n-octane, Octane, 1,1-dichloro-
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H16Cl2 |
| Molecular Weight | 182.06291 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 6 |
| Exact Mass | 182.06291 Da |
| Heavy Atoms | 10 |
| Complexity | 62.0 |
| SMILES | CCCCCCCC(Cl)Cl |
| InChIKey | OQYNFBPKTVQOKO-UHFFFAOYSA-N |
Chemical Property Profile of 1,1-Dichlorooctane
Property Insights of 1,1-Dichlorooctane
The XLogP value of 5.0 indicates that 1,1-Dichlorooctane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,1-Dichlorooctane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Dichlorooctane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,1-Dichlorooctane?
The CAS number of 1,1-Dichlorooctane is 20395-24-8.
What is the molecular formula of 1,1-Dichlorooctane?
The molecular formula of 1,1-Dichlorooctane is C8H16Cl2.
What is the molecular weight of 1,1-Dichlorooctane?
The molecular weight of 1,1-Dichlorooctane is 182.06291 g/mol.
Where can I buy 1,1-Dichlorooctane?
You can request a quote for 1,1-Dichlorooctane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1-Dichlorooctane?
Yes, CoreyChem provides custom synthesis services for 1,1-Dichlorooctane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.