1,2,3,3-Tetrachlorobutane
TL;DR: 1,2,3,3-Tetrachlorobutane (CAS 13138-51-7) is a chemical compound with molecular formula C4H6Cl4 and molecular weight 193.92236 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,3-tetrachlorobutane
Also Known As: 1,2,3,3-TETRACHLOROBUTANE, 1,2,3,3-Tetrachlorbutan, 1,2,3,3-Tetrachlor-butan, Butane,1,2,3,3-tetrachloro-
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H6Cl4 |
| Molecular Weight | 193.92236 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.91942 Da |
| Heavy Atoms | 8 |
| Complexity | 70.0 |
| SMILES | CC(C(CCl)Cl)(Cl)Cl |
| InChIKey | NGAAIHKWQFLRDY-UHFFFAOYSA-N |
Chemical Property Profile of 1,2,3,3-Tetrachlorobutane
Property Insights of 1,2,3,3-Tetrachlorobutane
The XLogP value of 3.0 indicates that 1,2,3,3-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, 1,2,3,3-Tetrachlorobutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,3-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
What is the CAS number of 1,2,3,3-Tetrachlorobutane?
The CAS number of 1,2,3,3-Tetrachlorobutane is 13138-51-7.
What is the molecular formula of 1,2,3,3-Tetrachlorobutane?
The molecular formula of 1,2,3,3-Tetrachlorobutane is C4H6Cl4.
What is the molecular weight of 1,2,3,3-Tetrachlorobutane?
The molecular weight of 1,2,3,3-Tetrachlorobutane is 193.92236 g/mol.
Where can I buy 1,2,3,3-Tetrachlorobutane?
You can request a quote for 1,2,3,3-Tetrachlorobutane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2,3,3-Tetrachlorobutane?
Yes, CoreyChem provides custom synthesis services for 1,2,3,3-Tetrachlorobutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.