| CAS Number | 959241-31-7 |
| Catalog Number | AG006A57(AGN-PC-0WB3ZW) |
| Chemical Name | (6-Chloropyrazin-2-yl)(pyrrolidin-1-yl)methanone |
| IUPAC Name | (6-chloropyrazin-2-yl)-pyrrolidin-1-ylmethanone |
| InChI | InChI=1S/C9H10ClN3O/c10-8-6-11-5-7(12-8)9(14)13-3-1-2-4-13/h5-6H,1-4H2 |
| InChI Key | PTLWXHNMPCCMKS-UHFFFAOYSA-N |
| MDL Number | MFCD09864600 |
| Molecular Formula | C9H10ClN3O |
| Molecular Weight | 211.6482 |
| SMILES | C1(C=NC=C(Cl)N=1)C(=O)N1CCCC1 |
| Synonyms | 959241-31-7,
2-CHLORO-6-(1-PYRROLIDINYLCARBONYL)PYRAZINE,
(6-Chloropyrazin-2-yl)(pyrrolidin-1-yl)methanone,
CTK5H8414,
DTXSID10651007,
MFCD09864600,
ZINC19092924,
AKOS006340218,
AJ-71955,
AB1007518,
2-chloro-6-(pyrrolidine-1-carbonyl)pyrazine,
Y-5908,
null,
(6-chloro-2-pyrazinyl)-1-pyrrolidinylMethanone,
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| Complexity | 218 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.649g/mol |
| Monoisotopic Mass | 211.051g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
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Certificate of Analysis
Lot Number