1,1,2,4-Tetrachlorobut-2-ene
TL;DR: 1,1,2,4-Tetrachlorobut-2-ene (CAS 3574-42-3) is a chemical compound with molecular formula C4H4Cl4 and molecular weight 191.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,2,4-tetrachlorobut-2-ene
Also Known As: 1,1,2,4-Tetrachlorobutene, 1,1,2,4-TETRACHLOROBUT-2-ENE
| Molecular Formula | C4H4Cl4 |
|---|---|
| Molecular Weight | 191.91 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.90376 |
| Heavy Atoms | 8 |
| Complexity | 86.0 |
Chemical Identifiers
| CAS Number | 3574-42-3 |
|---|---|
| SMILES | C(C=C(C(Cl)Cl)Cl)Cl |
| InChIKey | JMHDKPDUQSVLSP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1,2,4-Tetrachlorobut-2-ene (CAS 3574-42-3), with molecular formula C4H4Cl4 and molecular weight 191.91 g/mol. IUPAC: 1,1,2,4-tetrachlorobut-2-ene.
Chemical Property Profile of 1,1,2,4-Tetrachlorobut-2-ene
Property Insights of 1,1,2,4-Tetrachlorobut-2-ene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1,2,4-Tetrachlorobut-2-ene. With a topological polar surface area (TPSA) of 0.0 Ų, 1,1,2,4-Tetrachlorobut-2-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,2,4-Tetrachlorobut-2-ene 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 1,1,2,4-Tetrachlorobut-2-ene?
The CAS number of 1,1,2,4-Tetrachlorobut-2-ene is 3574-42-3.
What is the molecular formula of 1,1,2,4-Tetrachlorobut-2-ene?
The molecular formula of 1,1,2,4-Tetrachlorobut-2-ene is C4H4Cl4.
What is the molecular weight of 1,1,2,4-Tetrachlorobut-2-ene?
The molecular weight of 1,1,2,4-Tetrachlorobut-2-ene is 191.91 g/mol.
Where can I buy 1,1,2,4-Tetrachlorobut-2-ene?
You can request a quote for 1,1,2,4-Tetrachlorobut-2-ene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,2,4-Tetrachlorobut-2-ene?
Yes, KEHONG BIO provides custom synthesis services for 1,1,2,4-Tetrachlorobut-2-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.