| CAS Number | 230618-42-5 |
| Catalog Number | AG019EZ5(AGN-PC-0N668E) |
| Chemical Name | 2-bromo-4-pyrrolidin-1-ylpyridine |
| IUPAC Name | 2-bromo-4-pyrrolidin-1-ylpyridine |
| InChI | InChI=1S/C9H11BrN2/c10-9-7-8(3-4-11-9)12-5-1-2-6-12/h3-4,7H,1-2,5-6H2 |
| InChI Key | RFJRXIJRIORJQX-UHFFFAOYSA-N |
| MDL Number | MFCD09032268 |
| Molecular Formula | C9H11BrN2 |
| Molecular Weight | 227.1010 |
| SMILES | BrC1=NC=CC(N2CCCC2)=C1 |
| Synonyms | 2-bromo-4-(pyrrolidin-1-yl)pyridine,
230618-42-5,
2-bromo-4-pyrrolidin-1-ylpyridine,
2-bromo-4-pyrrolidin-1-yl-pyridine,
Pyridine, 2-bromo-4-(1-pyrrolidinyl)-,
SCHEMBL1634508,
CTK5I9097,
RFJRXIJRIORJQX-UHFFFAOYSA-N,
KS-00000TK4,
MFCD09032268,
ZINC21995909,
AKOS015945680,
AK521078,
DS-19083,
CS-0036804,
2-bromo-4-pyrrolidin-1-yl-pyridine, AldrichCPR,
CID10537269,
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| Complexity | 146 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.011g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.105g/mol |
| Monoisotopic Mass | 226.011g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 16.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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