1,6-Dichloro-2,5-dimethyl-1,5-hexadiene
TL;DR: 1,6-Dichloro-2,5-dimethyl-1,5-hexadiene (CAS 83682-48-8) is a chemical compound with molecular formula C8H12Cl2 and molecular weight 178.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1E,5E)-1,6-dichloro-2,5-dimethylhexa-1,5-diene
Also Known As: 1,6-DICHLORO-2,5-DIMETHYL-1,5-HEXADIENE, 1,6-dichloro-2,5-dimethylhexa-1,5-diene, J1.596.134A, (1E,5E)-1,6-dichloro-2,5-dimethylhexa-1,5-diene
| Molecular Formula | C8H12Cl2 |
|---|---|
| Molecular Weight | 178.03 g/mol |
| LogP | 4.0518 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 178.0316 |
| Heavy Atoms | 10 |
| Complexity | 127.33658 |
Chemical Identifiers
| CAS Number | 83682-48-8 |
|---|---|
| SMILES | C/C(=C\Cl)/CC/C(=C/Cl)/C |
Product Overview
1,6-Dichloro-2,5-dimethyl-1,5-hexadiene (CAS 83682-48-8), with molecular formula C8H12Cl2 and molecular weight 178.03 g/mol. IUPAC: (1E,5E)-1,6-dichloro-2,5-dimethylhexa-1,5-diene.
Chemical Property Profile of 1,6-Dichloro-2,5-dimethyl-1,5-hexadiene
Property Insights of 1,6-Dichloro-2,5-dimethyl-1,5-hexadiene
The XLogP value of 4.0518 indicates that 1,6-Dichloro-2,5-dimethyl-1,5-hexadiene 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-dimethyl-1,5-hexadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,6-Dichloro-2,5-dimethyl-1,5-hexadiene 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-Dichloro-2,5-dimethyl-1,5-hexadiene?
The CAS number of 1,6-Dichloro-2,5-dimethyl-1,5-hexadiene is 83682-48-8.
What is the molecular formula of 1,6-Dichloro-2,5-dimethyl-1,5-hexadiene?
The molecular formula of 1,6-Dichloro-2,5-dimethyl-1,5-hexadiene is C8H12Cl2.
What is the molecular weight of 1,6-Dichloro-2,5-dimethyl-1,5-hexadiene?
The molecular weight of 1,6-Dichloro-2,5-dimethyl-1,5-hexadiene is 178.03 g/mol.
Where can I buy 1,6-Dichloro-2,5-dimethyl-1,5-hexadiene?
You can request a quote for 1,6-Dichloro-2,5-dimethyl-1,5-hexadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,6-Dichloro-2,5-dimethyl-1,5-hexadiene?
Yes, KEHONG BIO provides custom synthesis services for 1,6-Dichloro-2,5-dimethyl-1,5-hexadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.