Adenosine, 3'-C-(trifluoromethyl)-
TL;DR: Adenosine, 3'-C-(trifluoromethyl)- (CAS 162894-39-5) is a chemical compound with molecular formula C11H12F3N5O4 and molecular weight 335.08414 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-3-(trifluoromethyl)oxolane-3,4-diol
Also Known As: Adenosine, 3'-C-(trifluoromethyl)-, 9H-Purin-6-amine, 9-[3-C-(trifluoromethyl)-b-D-ribofuranosyl]-, (2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-3-(trifluoromethyl)oxolane-3,4-diol, (2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-3-(trifluoromethyl)tetrahydrofuran-3,4-diol
Technical Specifications
| Molecular Formula | C11H12F3N5O4 |
| Molecular Weight | 335.08414 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 140.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 2 |
| Exact Mass | 335.08414 Da |
| Heavy Atoms | 23 |
| Complexity | 458.0 |
| SMILES | C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@]([C@H](O3)CO)(C(F)(F)F)O)O)N |
| InChIKey | YUEBKVVKYOKOCP-JUBFSOONSA-N |
Chemical Property Profile of Adenosine, 3'-C-(trifluoromethyl)-
Property Insights of Adenosine, 3'-C-(trifluoromethyl)-
The XLogP value of -0.1 indicates that Adenosine, 3'-C-(trifluoromethyl)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.0 Ų indicates high polarity, suggesting Adenosine, 3'-C-(trifluoromethyl)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Adenosine, 3'-C-(trifluoromethyl)- has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Adenosine, 3'-C-(trifluoromethyl)-?
The CAS number of Adenosine, 3'-C-(trifluoromethyl)- is 162894-39-5.
What is the molecular formula of Adenosine, 3'-C-(trifluoromethyl)-?
The molecular formula of Adenosine, 3'-C-(trifluoromethyl)- is C11H12F3N5O4.
What is the molecular weight of Adenosine, 3'-C-(trifluoromethyl)-?
The molecular weight of Adenosine, 3'-C-(trifluoromethyl)- is 335.08414 g/mol.
Where can I buy Adenosine, 3'-C-(trifluoromethyl)-?
You can request a quote for Adenosine, 3'-C-(trifluoromethyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Adenosine, 3'-C-(trifluoromethyl)-?
Yes, CoreyChem provides custom synthesis services for Adenosine, 3'-C-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.