| CAS Number | 892548-11-7 |
| Catalog Number | AG0087XA(AGN-PC-0WB5A1) |
| Chemical Name | 2-Bromo-4-(1-pyrrolidinylcarbonyl)pyridine |
| IUPAC Name | (2-bromopyridin-4-yl)-pyrrolidin-1-ylmethanone |
| InChI | InChI=1S/C10H11BrN2O/c11-9-7-8(3-4-12-9)10(14)13-5-1-2-6-13/h3-4,7H,1-2,5-6H2 |
| InChI Key | UNGGHSBYTDJINR-UHFFFAOYSA-N |
| MDL Number | MFCD12198445 |
| Molecular Formula | C10H11BrN2O |
| Molecular Weight | 255.1111 |
| SMILES | C(=O)(C1C=CN=C(Br)C=1)N1CCCC1 |
| Synonyms | 2-BROMO-4-(1-PYRROLIDINYLCARBONYL)PYRIDINE,
892548-11-7,
(2-BROMOPYRIDIN-4-YL)(PYRROLIDIN-1-YL)METHANONE,
SCHEMBL5014449,
CTK5G2695,
DTXSID70653244,
UNGGHSBYTDJINR-UHFFFAOYSA-N,
MFCD12198445,
ZINC29865973,
AKOS006337424,
MB11725,
AJ-83830,
DA-19283,
2-bromo-4-(pyrrolidine-1-carbonyl)pyridine,
FT-0727022,
Y-7133,
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| Complexity | 216 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.005g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 255.115g/mol |
| Monoisotopic Mass | 254.005g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 33.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number