3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene
TL;DR: 3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene (CAS 83682-55-7) is a chemical compound with molecular formula C8H8Cl4 and molecular weight 243.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene
Also Known As: (3E)-3,4-dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene
| Molecular Formula | C8H8Cl4 |
|---|---|
| Molecular Weight | 243.94 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.93506 |
| Heavy Atoms | 12 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 83682-55-7 |
|---|---|
| SMILES | C=C(CCl)C(=C(C(=C)CCl)Cl)Cl |
| InChIKey | DVZWOFBZTNHLHL-UHFFFAOYSA-N |
Product Overview
3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene (CAS 83682-55-7), with molecular formula C8H8Cl4 and molecular weight 243.94 g/mol. IUPAC: 3,4-dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene.
Chemical Property Profile of 3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene
Property Insights of 3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene
The XLogP value of 4.6 indicates that 3,4-Dichloro-2,5-bis(chloromethyl)hexa-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, 3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dichloro-2,5-bis(chloromethyl)hexa-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 3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene?
The CAS number of 3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene is 83682-55-7.
What is the molecular formula of 3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene?
The molecular formula of 3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene is C8H8Cl4.
What is the molecular weight of 3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene?
The molecular weight of 3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene is 243.94 g/mol.
Where can I buy 3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene?
You can request a quote for 3,4-Dichloro-2,5-bis(chloromethyl)hexa-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 3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dichloro-2,5-bis(chloromethyl)hexa-1,3,5-triene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.