1,1,4,4-Tetrachlorobutane
TL;DR: 1,1,4,4-Tetrachlorobutane (CAS 33455-24-2) is a chemical compound with molecular formula C4H6Cl4 and molecular weight 193.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,4,4-tetrachlorobutane
Also Known As: 1,1,4,4-TETRACHLOROBUTANE, 1,1,4,4-tetrachloro-butane, RefChem:1051718
| Molecular Formula | C4H6Cl4 |
|---|---|
| Molecular Weight | 193.92 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 195.91942 |
| Heavy Atoms | 8 |
| Complexity | 44.0 |
Chemical Identifiers
| CAS Number | 33455-24-2 |
|---|---|
| SMILES | C(CC(Cl)Cl)C(Cl)Cl |
| InChIKey | IXFRXRYBVZIBDO-UHFFFAOYSA-N |
Product Overview
1,1,4,4-Tetrachlorobutane (CAS 33455-24-2), with molecular formula C4H6Cl4 and molecular weight 193.92 g/mol. IUPAC: 1,1,4,4-tetrachlorobutane.
Chemical Property Profile of 1,1,4,4-Tetrachlorobutane
Property Insights of 1,1,4,4-Tetrachlorobutane
The XLogP value of 3.6 indicates that 1,1,4,4-Tetrachlorobutane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,1,4,4-Tetrachlorobutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,4,4-Tetrachlorobutane 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 1,1,4,4-Tetrachlorobutane?
The CAS number of 1,1,4,4-Tetrachlorobutane is 33455-24-2.
What is the molecular formula of 1,1,4,4-Tetrachlorobutane?
The molecular formula of 1,1,4,4-Tetrachlorobutane is C4H6Cl4.
What is the molecular weight of 1,1,4,4-Tetrachlorobutane?
The molecular weight of 1,1,4,4-Tetrachlorobutane is 193.92 g/mol.
Where can I buy 1,1,4,4-Tetrachlorobutane?
You can request a quote for 1,1,4,4-Tetrachlorobutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,4,4-Tetrachlorobutane?
Yes, KEHONG BIO provides custom synthesis services for 1,1,4,4-Tetrachlorobutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.