1,1,3,3,4,4-Hexachloro-1-butene
TL;DR: 1,1,3,3,4,4-Hexachloro-1-butene (CAS 34973-39-2) is a chemical compound with molecular formula C4H2Cl6 and molecular weight 259.83 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,3,3,4,4-hexachlorobut-1-ene
Also Known As: 1,1,3,3,4,4-hexachlorobut-1-ene, 1,1,3,3,4,4-Hexachloro-1-butene, 1-Butene, 1,1,3,3,4,4-hexachloro-, 1,1,3,3,4,4-hexachlorobutene, 1,1,3,3,4,4,-hexachloro-1-butene
| Molecular Formula | C4H2Cl6 |
|---|---|
| Molecular Weight | 259.83 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.82877 |
| Heavy Atoms | 10 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 34973-39-2 |
|---|---|
| SMILES | C(=C(Cl)Cl)C(C(Cl)Cl)(Cl)Cl |
| InChIKey | ABMSWFCHXPNDHQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1,3,3,4,4-Hexachloro-1-butene (CAS 34973-39-2), with molecular formula C4H2Cl6 and molecular weight 259.83 g/mol. IUPAC: 1,1,3,3,4,4-hexachlorobut-1-ene.
Chemical Property Profile of 1,1,3,3,4,4-Hexachloro-1-butene
Property Insights of 1,1,3,3,4,4-Hexachloro-1-butene
The XLogP value of 4.5 indicates that 1,1,3,3,4,4-Hexachloro-1-butene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,1,3,3,4,4-Hexachloro-1-butene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,3,3,4,4-Hexachloro-1-butene 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 1,1,3,3,4,4-Hexachloro-1-butene?
The CAS number of 1,1,3,3,4,4-Hexachloro-1-butene is 34973-39-2.
What is the molecular formula of 1,1,3,3,4,4-Hexachloro-1-butene?
The molecular formula of 1,1,3,3,4,4-Hexachloro-1-butene is C4H2Cl6.
What is the molecular weight of 1,1,3,3,4,4-Hexachloro-1-butene?
The molecular weight of 1,1,3,3,4,4-Hexachloro-1-butene is 259.83 g/mol.
Where can I buy 1,1,3,3,4,4-Hexachloro-1-butene?
You can request a quote for 1,1,3,3,4,4-Hexachloro-1-butene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,3,3,4,4-Hexachloro-1-butene?
Yes, KEHONG BIO provides custom synthesis services for 1,1,3,3,4,4-Hexachloro-1-butene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.