1,3,4,5,6-Pentachlorocyclohex-1-ene
TL;DR: 1,3,4,5,6-Pentachlorocyclohex-1-ene (CAS 1890-40-0) is a chemical compound with molecular formula C6H5Cl5 and molecular weight 251.88339 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3,4,5,6-pentachlorocyclohexene
Also Known As: beta-Pch, beta-Pentachlorocyclohexene, 1,3,4,5,6-pentachlorocyclohexene, PENTACHLOROCYCLOHEXENE, 2,3,4,5,6-pentachlorocyclohexene
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H5Cl5 |
| Molecular Weight | 251.88339 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 253.88043 Da |
| Heavy Atoms | 11 |
| Complexity | 178.0 |
| SMILES | C1=C(C(C(C(C1Cl)Cl)Cl)Cl)Cl |
| InChIKey | MQYAVRUCONBHOR-UHFFFAOYSA-N |
Product Description
Applications: 1,3,4,5,6-Pentachlorocyclohex-1-ene is used in catalysis, accelerating transformations in both laboratory and industrial settings, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 1,3,4,5,6-Pentachlorocyclohex-1-ene (CAS 1890-40-0) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
1,3,4,5,6-Pentachlorocyclohex-1-ene is a catalyst and catalytic reagent identified by CAS number 1890-40-0 and the molecular formula C6H5Cl5 and a molecular weight of 251.88 g/mol. It is also known as beta-Pch and beta-Pentachlorocyclohexene.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 1,3,4,5,6-Pentachlorocyclohex-1-ene
Property Insights of 1,3,4,5,6-Pentachlorocyclohex-1-ene
The XLogP value of 3.8 indicates that 1,3,4,5,6-Pentachlorocyclohex-1-ene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,3,4,5,6-Pentachlorocyclohex-1-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,4,5,6-Pentachlorocyclohex-1-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
What is the CAS number of 1,3,4,5,6-Pentachlorocyclohex-1-ene?
The CAS number of 1,3,4,5,6-Pentachlorocyclohex-1-ene is 1890-40-0.
What is the molecular formula of 1,3,4,5,6-Pentachlorocyclohex-1-ene?
The molecular formula of 1,3,4,5,6-Pentachlorocyclohex-1-ene is C6H5Cl5.
What is the molecular weight of 1,3,4,5,6-Pentachlorocyclohex-1-ene?
The molecular weight of 1,3,4,5,6-Pentachlorocyclohex-1-ene is 251.88339 g/mol.
What are the applications of 1,3,4,5,6-Pentachlorocyclohex-1-ene?
1,3,4,5,6-Pentachlorocyclohex-1-ene is used in catalysis, accelerating transformations in both laboratory and industrial settings, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis....
Where can I buy 1,3,4,5,6-Pentachlorocyclohex-1-ene?
You can request a quote for 1,3,4,5,6-Pentachlorocyclohex-1-ene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3,4,5,6-Pentachlorocyclohex-1-ene?
Yes, CoreyChem provides custom synthesis services for 1,3,4,5,6-Pentachlorocyclohex-1-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.