| CAS Number | 1220040-28-7 |
| Catalog Number | AG009K4G |
| Chemical Name | 4-(Pyrrolidin-3-yloxy)pyridine dihydrochloride |
| IUPAC Name | 4-pyrrolidin-3-yloxypyridine;dihydrochloride |
| InChI | InChI=1S/C9H12N2O.2ClH/c1-4-10-5-2-8(1)12-9-3-6-11-7-9;;/h1-2,4-5,9,11H,3,6-7H2;2*1H |
| InChI Key | NVFYGRPPQCWOAG-UHFFFAOYSA-N |
| MDL Number | MFCD15475008 |
| Molecular Formula | C9H14Cl2N2O |
| Molecular Weight | 237.1263 |
| SMILES | Cl.Cl.C1NCC(OC2=CC=NC=C2)C1 |
| Synonyms | 4-(Pyrrolidin-3-yloxy)pyridine dihydrochloride,
1220040-28-7,
4-(PYRROLIDIN-3-YLOXY)-PYRIDINE DIHYDROCHLORIDE,
2540AJ,
AKOS025146744,
NE63008,
AK164850,
F2147-2571,
C9H12N2O.2HCl,
933716-88-2,
|
| Complexity | 135 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 236.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.124g/mol |
| Monoisotopic Mass | 236.048g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 34.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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