1,1,1,3-Tetrachloropropane
TL;DR: 1,1,1,3-Tetrachloropropane (CAS 1070-78-6) is a chemical compound with molecular formula C3H4Cl4 and molecular weight 179.90671 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1,1,3-tetrachloropropane
Also Known As: 1,1,1,3-Tetrachloropropane, 1,1,1,3-Tetrachloro-propane, Tetrachloropropane, PROPANE, 1,1,1,3-TETRACHLORO-, 1,1,1,3-tetrachloro-propan
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C3H4Cl4 |
| Molecular Weight | 179.90671 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 181.90376 Da |
| Heavy Atoms | 7 |
| Complexity | 45.0 |
| SMILES | C(CCl)C(Cl)(Cl)Cl |
| InChIKey | UTACNSITJSJFHA-UHFFFAOYSA-N |
Chemical Property Profile of 1,1,1,3-Tetrachloropropane
Property Insights of 1,1,1,3-Tetrachloropropane
The XLogP value of 3.0 indicates that 1,1,1,3-Tetrachloropropane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,1,1,3-Tetrachloropropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1,3-Tetrachloropropane 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 1,1,1,3-Tetrachloropropane?
The CAS number of 1,1,1,3-Tetrachloropropane is 1070-78-6.
What is the molecular formula of 1,1,1,3-Tetrachloropropane?
The molecular formula of 1,1,1,3-Tetrachloropropane is C3H4Cl4.
What is the molecular weight of 1,1,1,3-Tetrachloropropane?
The molecular weight of 1,1,1,3-Tetrachloropropane is 179.90671 g/mol.
Where can I buy 1,1,1,3-Tetrachloropropane?
You can request a quote for 1,1,1,3-Tetrachloropropane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1,1,3-Tetrachloropropane?
Yes, CoreyChem provides custom synthesis services for 1,1,1,3-Tetrachloropropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.