| CAS Number | 1955547-02-0 |
| Catalog Number | AG01B2O3 |
| Chemical Name | 1-(5-Fluoropyridin-2-yl)piperazine dihydrochloride |
| IUPAC Name | 1-(5-fluoropyridin-2-yl)piperazine;dihydrochloride |
| InChI | InChI=1S/C9H12FN3.2ClH/c10-8-1-2-9(12-7-8)13-5-3-11-4-6-13;;/h1-2,7,11H,3-6H2;2*1H |
| InChI Key | NIONQJYXPBFCKX-UHFFFAOYSA-N |
| MDL Number | MFCD28891465 |
| Molecular Formula | C9H14Cl2FN3 |
| Molecular Weight | 254.1320 |
| SMILES | Cl.Cl.FC=1C=CC(=NC1)N1CCNCC1 |
| Synonyms | 1-(5-fluoropyridin-2-yl)piperazine dihydrochloride,
1955547-02-0,
MFCD28891465,
1-(5-Fluoropyridin-2-yl)piperazine 2HCl,
CS-0080285,
|
| Complexity | 159 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.055g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 254.13g/mol |
| Monoisotopic Mass | 253.055g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 28.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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