1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene
TL;DR: 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene (CAS 83682-54-6) is a chemical compound with molecular formula C8H10Cl2 and molecular weight 176.01596 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,6-dichloro-2,5-dimethylhexa-1,3,5-triene
Also Known As: 1,6-dichloro-2,5-dimethylhexa-1,3,5-triene, 1,3,5-Hexatriene,1,6-dichloro-2,5-dimethyl-
Technical Specifications
| Molecular Formula | C8H10Cl2 |
| Molecular Weight | 176.01596 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.01596 Da |
| Heavy Atoms | 10 |
| Complexity | 156.0 |
| SMILES | CC(=CCl)C=CC(=CCl)C |
| InChIKey | NVQKJHAZAGIHHD-UHFFFAOYSA-N |
Chemical Property Profile of 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene
Property Insights of 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene
The XLogP value of 4.3 indicates that 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene 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 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene?
The CAS number of 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene is 83682-54-6.
What is the molecular formula of 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene?
The molecular formula of 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene is C8H10Cl2.
What is the molecular weight of 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene?
The molecular weight of 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene is 176.01596 g/mol.
Where can I buy 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene?
You can request a quote for 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene?
Yes, CoreyChem provides custom synthesis services for 1,6-Dichloro-2,5-dimethylhexa-1,3,5-triene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.