3-Propyl-1-adamantanol
TL;DR: 3-Propyl-1-adamantanol (CAS 15598-88-6) is a chemical compound with molecular formula C13H22O and molecular weight 194.16707 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-propyladamantan-1-ol
Also Known As: 3-propyladamantan-1-ol, 3-Propyl-1-adamantanol, 3-n-Propyl-adamantol-1, 3-Propyl-1-adamantanol #, 3-Propyltricyclo[3.3.1.13,7]decan-1-ol
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H22O |
| Molecular Weight | 194.16707 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.16707 Da |
| Heavy Atoms | 14 |
| Complexity | 232.0 |
| SMILES | CCCC12CC3CC(C1)CC(C3)(C2)O |
| InChIKey | DASJOTIHKLXABK-UHFFFAOYSA-N |
Chemical Property Profile of 3-Propyl-1-adamantanol
Property Insights of 3-Propyl-1-adamantanol
The XLogP value of 4.0 indicates that 3-Propyl-1-adamantanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 3-Propyl-1-adamantanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Propyl-1-adamantanol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Propyl-1-adamantanol?
The CAS number of 3-Propyl-1-adamantanol is 15598-88-6.
What is the molecular formula of 3-Propyl-1-adamantanol?
The molecular formula of 3-Propyl-1-adamantanol is C13H22O.
What is the molecular weight of 3-Propyl-1-adamantanol?
The molecular weight of 3-Propyl-1-adamantanol is 194.16707 g/mol.
Where can I buy 3-Propyl-1-adamantanol?
You can request a quote for 3-Propyl-1-adamantanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Propyl-1-adamantanol?
Yes, CoreyChem provides custom synthesis services for 3-Propyl-1-adamantanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.