| CAS Number | 174740-86-4 |
| Catalog Number | AG01E2S1(AGN-PC-0QAN30) |
| Chemical Name | (S)-3-(2-AZETIDINYLMETHOXY)PYRIDINE DIHYDROCHLORIDE |
| IUPAC Name | 3-[[(2S)-azetidin-2-yl]methoxy]pyridine;dihydrochloride |
| InChI | InChI=1S/C9H12N2O.2ClH/c1-2-9(6-10-4-1)12-7-8-3-5-11-8;;/h1-2,4,6,8,11H,3,5,7H2;2*1H/t8-;;/m0../s1 |
| InChI Key | GVEVDINKRFDXFP-JZGIKJSDSA-N |
| MDL Number | MFCD06804600 |
| Molecular Formula | C9H14Cl2N2O |
| Molecular Weight | 237.1263 |
| SMILES | C(Oc1cccnc1)[C@@H]1CCN1.Cl.Cl |
| Synonyms | 174740-86-4,
GVEVDINKRFDXFP-JZGIKJSDSA-N,
A 85380 dihydrochloride,
SCHEMBL3217337,
AKOS025142039,
LS-130282,
(S)-3-(2-Azetidinylmethoxy)-pyridineDihydrochloride,
(S)-3-(2-Azetidinylmethoxy)pyridine dihydrochloride,
3-(2-(S)-azetidinylmethoxy)pyridine dihydrochloride,
3-[(2S)-2-Azetidinylmethoxy]-pyridine dihydrochloride,
CID10399247,
(S)-3-(2-Azetidinylmethoxy)pyridine 2HCl,
3-[[(2S)-azetidin-2-yl]methoxy]pyridine Dihydrochloride,
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 1 |
| 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 | 3 |
| Topological Polar Surface Area | 34.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number