1,6-Dichlorohexa-1,3,5-triene
TL;DR: 1,6-Dichlorohexa-1,3,5-triene (CAS 69645-07-4) is a chemical compound with molecular formula C6H6Cl2 and molecular weight 147.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1E,3E,5E)-1,6-dichlorohexa-1,3,5-triene
Also Known As: 1,6-DICHLOROHEXA-1,3,5-TRIENE, 1,6-Dichloro-1,3,5-hexatriene, J1.589.519E, (1E,3E,5E)-1,6-dichlorohexa-1,3,5-triene
| Molecular Formula | C6H6Cl2 |
|---|---|
| Molecular Weight | 147.98 g/mol |
| LogP | 3.0476 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 147.98465 |
| Heavy Atoms | 8 |
| Complexity | 97.696945 |
Chemical Identifiers
| CAS Number | 69645-07-4 |
|---|---|
| SMILES | C(=C/C=C/Cl)\C=C\Cl |
Product Overview
1,6-Dichlorohexa-1,3,5-triene (CAS 69645-07-4), with molecular formula C6H6Cl2 and molecular weight 147.98 g/mol. IUPAC: (1E,3E,5E)-1,6-dichlorohexa-1,3,5-triene.
Chemical Property Profile of 1,6-Dichlorohexa-1,3,5-triene
Property Insights of 1,6-Dichlorohexa-1,3,5-triene
The XLogP value of 3.0476 indicates that 1,6-Dichlorohexa-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-Dichlorohexa-1,3,5-triene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,6-Dichlorohexa-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
Frequently Asked Questions
What is the CAS number of 1,6-Dichlorohexa-1,3,5-triene?
The CAS number of 1,6-Dichlorohexa-1,3,5-triene is 69645-07-4.
What is the molecular formula of 1,6-Dichlorohexa-1,3,5-triene?
The molecular formula of 1,6-Dichlorohexa-1,3,5-triene is C6H6Cl2.
What is the molecular weight of 1,6-Dichlorohexa-1,3,5-triene?
The molecular weight of 1,6-Dichlorohexa-1,3,5-triene is 147.98 g/mol.
Where can I buy 1,6-Dichlorohexa-1,3,5-triene?
You can request a quote for 1,6-Dichlorohexa-1,3,5-triene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,6-Dichlorohexa-1,3,5-triene?
Yes, KEHONG BIO provides custom synthesis services for 1,6-Dichlorohexa-1,3,5-triene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.