9-Allyl-2-chlorothioxanthen-9-ol
TL;DR: 9-Allyl-2-chlorothioxanthen-9-ol (CAS 33049-88-6) is a chemical compound with molecular formula C16H13ClOS and molecular weight 288.03757 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-9-prop-2-enylthioxanthen-9-ol
Also Known As: 9-Allyl-2-chlorothioxanthen-9-ol, starbld0001715, 2-chloro-9-prop-2-enylthioxanthen-9-ol, 9-allyl-2-chloro-9h-thioxanthen-9-ol, 2-Chlor-9-allyl-thiaxanthen-9-ol
Technical Specifications
| Molecular Formula | C16H13ClOS |
| Molecular Weight | 288.03757 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.03757 Da |
| Heavy Atoms | 19 |
| Complexity | 348.0 |
| SMILES | C=CCC1(C2=CC=CC=C2SC3=C1C=C(C=C3)Cl)O |
| InChIKey | TVKIVQFMOWEWHQ-UHFFFAOYSA-N |
Chemical Property Profile of 9-Allyl-2-chlorothioxanthen-9-ol
Property Insights of 9-Allyl-2-chlorothioxanthen-9-ol
The XLogP value of 4.4 indicates that 9-Allyl-2-chlorothioxanthen-9-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.5 Ų, 9-Allyl-2-chlorothioxanthen-9-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Allyl-2-chlorothioxanthen-9-ol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 9-Allyl-2-chlorothioxanthen-9-ol?
The CAS number of 9-Allyl-2-chlorothioxanthen-9-ol is 33049-88-6.
What is the molecular formula of 9-Allyl-2-chlorothioxanthen-9-ol?
The molecular formula of 9-Allyl-2-chlorothioxanthen-9-ol is C16H13ClOS.
What is the molecular weight of 9-Allyl-2-chlorothioxanthen-9-ol?
The molecular weight of 9-Allyl-2-chlorothioxanthen-9-ol is 288.03757 g/mol.
Where can I buy 9-Allyl-2-chlorothioxanthen-9-ol?
You can request a quote for 9-Allyl-2-chlorothioxanthen-9-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 9-Allyl-2-chlorothioxanthen-9-ol?
Yes, CoreyChem provides custom synthesis services for 9-Allyl-2-chlorothioxanthen-9-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.