1-Fluoro-1-deoxyephedrine
TL;DR: 1-Fluoro-1-deoxyephedrine (CAS 161403-39-0) is a chemical compound with molecular formula C10H14FN and molecular weight 166.11356 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,2S)-1-(18F)fluoro-N-methyl-1-phenylpropan-2-amine
Also Known As: 1-Fluoro-1-deoxyephedrine, (18F)Fde, (18F)Fdp, 1-Fluoro-1-deoxypseudoephedrine, 1-(~18~F)Fluoro-N-methyl-1-phenylpropan-2-amine
Technical Specifications
| Molecular Formula | C10H14FN |
| Molecular Weight | 166.11356 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.11356 Da |
| Heavy Atoms | 12 |
| Complexity | 121.0 |
| SMILES | C[C@@H]([C@@H](C1=CC=CC=C1)[18F])NC |
| InChIKey | QHGKNGIWQABHRY-QJOTUPEMSA-N |
Chemical Property Profile of 1-Fluoro-1-deoxyephedrine
Property Insights of 1-Fluoro-1-deoxyephedrine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Fluoro-1-deoxyephedrine. With a topological polar surface area (TPSA) of 12.0 Ų, 1-Fluoro-1-deoxyephedrine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Fluoro-1-deoxyephedrine 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 1-Fluoro-1-deoxyephedrine?
The CAS number of 1-Fluoro-1-deoxyephedrine is 161403-39-0.
What is the molecular formula of 1-Fluoro-1-deoxyephedrine?
The molecular formula of 1-Fluoro-1-deoxyephedrine is C10H14FN.
What is the molecular weight of 1-Fluoro-1-deoxyephedrine?
The molecular weight of 1-Fluoro-1-deoxyephedrine is 166.11356 g/mol.
Where can I buy 1-Fluoro-1-deoxyephedrine?
You can request a quote for 1-Fluoro-1-deoxyephedrine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Fluoro-1-deoxyephedrine?
Yes, CoreyChem provides custom synthesis services for 1-Fluoro-1-deoxyephedrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.