Sulfide, pentachlorophenyl 2-propynyl
TL;DR: Sulfide, pentachlorophenyl 2-propynyl (CAS 73927-09-0) is a chemical compound with molecular formula C9H3Cl5S and molecular weight 317.8398 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,4,5-pentachloro-6-prop-2-ynylsulfanylbenzene
Also Known As: Pentachlorophenyl propargyl sulfide, Pentachlorophenyl 2-propynyl sulfide, Sulfide, pentachlorophenyl 2-propynyl, Benzene, pentachloro(2-propynylthio)-, KST-1B8498
Technical Specifications
| Molecular Formula | C9H3Cl5S |
| Molecular Weight | 317.8398 g/mol |
| XLogP | 5.7 |
| Topological Polar Surface Area (TPSA) | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 319.83685 Da |
| Heavy Atoms | 15 |
| Complexity | 246.0 |
| SMILES | C#CCSC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl |
| InChIKey | HHQADIOZIVJTOS-UHFFFAOYSA-N |
Chemical Property Profile of Sulfide, pentachlorophenyl 2-propynyl
Property Insights of Sulfide, pentachlorophenyl 2-propynyl
The XLogP value of 5.7 indicates that Sulfide, pentachlorophenyl 2-propynyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, Sulfide, pentachlorophenyl 2-propynyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sulfide, pentachlorophenyl 2-propynyl has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Sulfide, pentachlorophenyl 2-propynyl?
The CAS number of Sulfide, pentachlorophenyl 2-propynyl is 73927-09-0.
What is the molecular formula of Sulfide, pentachlorophenyl 2-propynyl?
The molecular formula of Sulfide, pentachlorophenyl 2-propynyl is C9H3Cl5S.
What is the molecular weight of Sulfide, pentachlorophenyl 2-propynyl?
The molecular weight of Sulfide, pentachlorophenyl 2-propynyl is 317.8398 g/mol.
Where can I buy Sulfide, pentachlorophenyl 2-propynyl?
You can request a quote for Sulfide, pentachlorophenyl 2-propynyl directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Sulfide, pentachlorophenyl 2-propynyl?
Yes, CoreyChem provides custom synthesis services for Sulfide, pentachlorophenyl 2-propynyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.