| CAS Number | 1065074-87-4 |
| Catalog Number | AG003J38(AGN-PC-07XTX5) |
| Chemical Name | 3-Bromo-5-nitro-2-(piperidin-1-yl)pyridine |
| IUPAC Name | 3-bromo-5-nitro-2-piperidin-1-ylpyridine |
| InChI | InChI=1S/C10H12BrN3O2/c11-9-6-8(14(15)16)7-12-10(9)13-4-2-1-3-5-13/h6-7H,1-5H2 |
| InChI Key | NRAXSTYTCXKRLR-UHFFFAOYSA-N |
| MDL Number | MFCD11053787 |
| Molecular Formula | C10H12BrN3O2 |
| Molecular Weight | 286.1252 |
| SMILES | O=[N+](C1=CN=C(N2CCCCC2)C(Br)=C1)[O-] |
| Synonyms | 3-Bromo-5-nitro-2-(piperidin-1-yl)pyridine,
1065074-87-4,
ACMC-2098l6,
CTK4A4600,
DTXSID60674529,
ANW-15400,
MFCD11053787,
ZINC38537071,
AKOS015834051,
RTR-001304,
AJ-95856,
AX8228747,
BC6235000,
ST2404965,
TR-001304,
Z6892,
A-4403,
I02-3121,
C10H12BrN3O2,
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| Complexity | 253 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 285.011g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 286.129g/mol |
| Monoisotopic Mass | 285.011g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 62A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number