| CAS Number | 1909335-92-7 |
| Catalog Number | AG01B2FR |
| Chemical Name | 1-(pyridin-3-yl)-2-azaspiro[3.3]heptane dihydrochloride |
| IUPAC Name | 3-pyridin-3-yl-2-azaspiro[3.3]heptane;dihydrochloride |
| InChI | InChI=1S/C11H14N2.2ClH/c1-3-9(7-12-6-1)10-11(8-13-10)4-2-5-11;;/h1,3,6-7,10,13H,2,4-5,8H2;2*1H |
| InChI Key | KRUGJCOFZWENEC-UHFFFAOYSA-N |
| MDL Number | MFCD29907411 |
| Molecular Formula | C11H16Cl2N2 |
| Molecular Weight | 247.1641 |
| SMILES | Cl.Cl.C1CC2(C(C3=CN=CC=C3)NC2)C1 |
| Synonyms | 1-(pyridin-3-yl)-2-azaspiro[3.3]heptane dihydrochloride,
1909335-92-7,
AKOS033922746,
Z2473347452,
|
| Complexity | 198 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 246.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 247.163g/mol |
| Monoisotopic Mass | 246.069g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number