| CAS Number | 1260847-45-7 |
| Catalog Number | AG01DDOL |
| Chemical Name | 3-((2R)PYRROLIDIN-2-YL)-2-CHLORO-5-FLUOROPYRIDINE DIHYDROCHLORIDE |
| IUPAC Name | 2-chloro-5-fluoro-3-[(2R)-pyrrolidin-2-yl]pyridine;dihydrochloride |
| InChI | InChI=1S/C9H10ClFN2.2ClH/c10-9-7(4-6(11)5-13-9)8-2-1-3-12-8;;/h4-5,8,12H,1-3H2;2*1H/t8-;;/m1../s1 |
| InChI Key | DLVSKBBUCHRGQP-YCBDHFTFSA-N |
| MDL Number | MFCD00235803 |
| Molecular Formula | C9H12Cl3FN2 |
| Molecular Weight | 273.5624 |
| SMILES | FC1=CN=C(Cl)C([C@@H]2NCCC2)=C1.[H]Cl.[H]Cl |
| Synonyms | SCHEMBL932946,
DLVSKBBUCHRGQP-YCBDHFTFSA-N,
1260847-45-7,
(R)-2-chloro-5-fluoro-3-(pyrrolidin-2-yl)pyridine dihydrochloride,
3-((2R)PYRROLIDIN-2-YL)-2-CHLORO-5-FLUOROPYRIDINE DIHYDROCHLORIDE,
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| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 272.005g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 273.557g/mol |
| Monoisotopic Mass | 272.005g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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