| CAS Number | 1841473-77-5 |
| Catalog Number | AG01BV8F |
| Chemical Name | (3S)-1-(6-chloropyrazin-2-yl)pyrrolidin-3-ol |
| IUPAC Name | 1-(6-chloropyrazin-2-yl)pyrrolidin-3-ol |
| InChI | InChI=1S/C8H10ClN3O/c9-7-3-10-4-8(11-7)12-2-1-6(13)5-12/h3-4,6,13H,1-2,5H2 |
| InChI Key | XEFKCMOGRCBXAO-UHFFFAOYSA-N |
| MDL Number | MFCD30476302 |
| Molecular Formula | C8H10ClN3O |
| Molecular Weight | 199.6375 |
| SMILES | O[C@@H]1CN(C2=NC(Cl)=CN=C2)CC1 |
| Synonyms | 1-(6-CHLORO-2-PYRAZINYL)-3-PYRROLIDINOL,
1-(6-chloropyrazin-2-yl)pyrrolidin-3-ol,
959239-43-1,
(3S)-1-(6-chloropyrazin-2-yl)pyrrolidin-3-ol,
1841473-77-5,
CTK8A0418,
AKOS012241333,
AB54308,
TR-068748,
EN300-80221,
Z-1563,
|
| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.638g/mol |
| Monoisotopic Mass | 199.051g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 49.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number