3-(Trifluoromethyl)adamantan-1-amine
TL;DR: 3-(Trifluoromethyl)adamantan-1-amine (CAS 130974-28-6) is a chemical compound with molecular formula C11H16F3N and molecular weight 219.12349 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(trifluoromethyl)adamantan-1-amine
Also Known As: 3-(trifluoromethyl)adamantan-1-amine, 3-(trifluoromethyl)tricyclo[3.3.1.1~3,7~]decan-1-amine
Technical Specifications
| Molecular Formula | C11H16F3N |
| Molecular Weight | 219.12349 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 219.12349 Da |
| Heavy Atoms | 15 |
| Complexity | 283.0 |
| SMILES | C1C2CC3(CC1CC(C2)(C3)N)C(F)(F)F |
| InChIKey | HRSPHBYURWVDMU-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Trifluoromethyl)adamantan-1-amine
Property Insights of 3-(Trifluoromethyl)adamantan-1-amine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Trifluoromethyl)adamantan-1-amine. With a topological polar surface area (TPSA) of 26.0 Ų, 3-(Trifluoromethyl)adamantan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Trifluoromethyl)adamantan-1-amine has 1 hydrogen bond donor(s) and 4 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-(Trifluoromethyl)adamantan-1-amine?
The CAS number of 3-(Trifluoromethyl)adamantan-1-amine is 130974-28-6.
What is the molecular formula of 3-(Trifluoromethyl)adamantan-1-amine?
The molecular formula of 3-(Trifluoromethyl)adamantan-1-amine is C11H16F3N.
What is the molecular weight of 3-(Trifluoromethyl)adamantan-1-amine?
The molecular weight of 3-(Trifluoromethyl)adamantan-1-amine is 219.12349 g/mol.
Where can I buy 3-(Trifluoromethyl)adamantan-1-amine?
You can request a quote for 3-(Trifluoromethyl)adamantan-1-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Trifluoromethyl)adamantan-1-amine?
Yes, CoreyChem provides custom synthesis services for 3-(Trifluoromethyl)adamantan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.