| CAS Number | 910385-92-1 |
| Catalog Number | AG01BA2B |
| Chemical Name | 2-[3-fluoro-4-(morpholin-4-yl)phenyl]ethan-1-amine |
| IUPAC Name | 2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine |
| InChI | InChI=1S/C12H17FN2O/c13-11-9-10(3-4-14)1-2-12(11)15-5-7-16-8-6-15/h1-2,9H,3-8,14H2 |
| InChI Key | JSZBKGXHHJOSCC-UHFFFAOYSA-N |
| MDL Number | MFCD08450371 |
| Molecular Formula | C12H17FN2O |
| Molecular Weight | 224.2746 |
| SMILES | NCCC1=CC(F)=C(N2CCOCC2)C=C1 |
| Synonyms | ZINC44399070,
AKOS013096447,
BC4521271,
EN300-207712,
2-[3-fluoro-4-(morpholin-4-yl)phenyl]ethan-1-amine,
910385-92-1,
|
| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.132g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.279g/mol |
| Monoisotopic Mass | 224.132g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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