Octachlorobutene
TL;DR: Octachlorobutene (CAS 39388-41-5) is a chemical compound with molecular formula C4Cl8 and molecular weight 327.75 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,2,3,3,4,4,4-octachlorobut-1-ene
Also Known As: Octachlorobutene, PERCHLOROBUTENE, octachloro-1-butene, octachlorobut-1-ene, Butene, octachloro-
| Molecular Formula | C4Cl8 |
|---|---|
| Molecular Weight | 327.75 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 327.75082 |
| Heavy Atoms | 12 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 39388-41-5 |
|---|---|
| SMILES | C(=C(Cl)Cl)(C(C(Cl)(Cl)Cl)(Cl)Cl)Cl |
| InChIKey | CAEGINLAOUNGOL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octachlorobutene (CAS 39388-41-5), with molecular formula C4Cl8 and molecular weight 327.75 g/mol. IUPAC: 1,1,2,3,3,4,4,4-octachlorobut-1-ene.
Chemical Property Profile of Octachlorobutene
Property Insights of Octachlorobutene
The XLogP value of 5.4 indicates that Octachlorobutene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Octachlorobutene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octachlorobutene 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 Octachlorobutene?
The CAS number of Octachlorobutene is 39388-41-5.
What is the molecular formula of Octachlorobutene?
The molecular formula of Octachlorobutene is C4Cl8.
What is the molecular weight of Octachlorobutene?
The molecular weight of Octachlorobutene is 327.75 g/mol.
Where can I buy Octachlorobutene?
You can request a quote for Octachlorobutene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octachlorobutene?
Yes, KEHONG BIO provides custom synthesis services for Octachlorobutene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.