1,1,1,2,3,3,4,4-Octachlorobutane
TL;DR: 1,1,1,2,3,3,4,4-Octachlorobutane (CAS 32694-76-1) is a chemical compound with molecular formula C4H2Cl8 and molecular weight 329.77 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1,2,3,3,4,4-octachlorobutane
Also Known As: 1,1,1,2,3,3,4,4-OCTACHLOROBUTANE, J1.616.787H, RefChem:212766
| Molecular Formula | C4H2Cl8 |
|---|---|
| Molecular Weight | 329.77 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 333.76056 |
| Heavy Atoms | 12 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 32694-76-1 |
|---|---|
| SMILES | C(C(C(Cl)Cl)(Cl)Cl)(C(Cl)(Cl)Cl)Cl |
| InChIKey | ZPQRGCPCYFBWSJ-UHFFFAOYSA-N |
Product Overview
1,1,1,2,3,3,4,4-Octachlorobutane (CAS 32694-76-1), with molecular formula C4H2Cl8 and molecular weight 329.77 g/mol. IUPAC: 1,1,1,2,3,3,4,4-octachlorobutane.
Chemical Property Profile of 1,1,1,2,3,3,4,4-Octachlorobutane
Property Insights of 1,1,1,2,3,3,4,4-Octachlorobutane
The XLogP value of 5.2 indicates that 1,1,1,2,3,3,4,4-Octachlorobutane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,1,1,2,3,3,4,4-Octachlorobutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1,2,3,3,4,4-Octachlorobutane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1,1,2,3,3,4,4-Octachlorobutane?
The CAS number of 1,1,1,2,3,3,4,4-Octachlorobutane is 32694-76-1.
What is the molecular formula of 1,1,1,2,3,3,4,4-Octachlorobutane?
The molecular formula of 1,1,1,2,3,3,4,4-Octachlorobutane is C4H2Cl8.
What is the molecular weight of 1,1,1,2,3,3,4,4-Octachlorobutane?
The molecular weight of 1,1,1,2,3,3,4,4-Octachlorobutane is 329.77 g/mol.
Where can I buy 1,1,1,2,3,3,4,4-Octachlorobutane?
You can request a quote for 1,1,1,2,3,3,4,4-Octachlorobutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,1,2,3,3,4,4-Octachlorobutane?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1,2,3,3,4,4-Octachlorobutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.