| CAS Number | 1909336-86-2 |
| Catalog Number | AG01C2DE |
| Chemical Name | 1-(3-Fluoropyridin-2-yl)ethan-1-amine dihydrochloride |
| IUPAC Name | 1-(3-fluoropyridin-2-yl)ethanamine;dihydrochloride |
| InChI | InChI=1S/C7H9FN2.2ClH/c1-5(9)7-6(8)3-2-4-10-7;;/h2-5H,9H2,1H3;2*1H |
| InChI Key | ZVSCQEPBLFCSKQ-UHFFFAOYSA-N |
| MDL Number | MFCD29047646 |
| Molecular Formula | C7H11Cl2FN2 |
| Molecular Weight | 213.0800 |
| SMILES | CC(C1=NC=CC=C1F)N.[H]Cl.[H]Cl |
| Synonyms | 1-(3-fluoropyridin-2-yl)ethan-1-amine dihydrochloride,
1909336-86-2,
(R)-1-(3-Fluoropyridin-2-yl)ethanamine dihydrochloride,
(S)-1-(3-Fluoropyridin-2-yl)ethanamine dihydrochloride,
1391462-15-9,
Z2284396256,
1391475-97-0,
|
| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.028g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 213.077g/mol |
| Monoisotopic Mass | 212.028g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number