| CAS Number | 1033202-53-7 |
| Catalog Number | AG003MKL(AGN-PC-07XTUV) |
| Chemical Name | 5-Bromo-2-cyclopentylamino-3-nitropyridine |
| IUPAC Name | 5-bromo-N-cyclopentyl-3-nitropyridin-2-amine |
| InChI | InChI=1S/C10H12BrN3O2/c11-7-5-9(14(15)16)10(12-6-7)13-8-3-1-2-4-8/h5-6,8H,1-4H2,(H,12,13) |
| InChI Key | HWETUADXWHBETB-UHFFFAOYSA-N |
| MDL Number | MFCD08692161 |
| Molecular Formula | C10H12BrN3O2 |
| Molecular Weight | 286.1252 |
| SMILES | O=[N+](C1=CC(Br)=CN=C1NC2CCCC2)[O-] |
| Synonyms | 1033202-53-7,
5-Bromo-N-cyclopentyl-3-nitropyridin-2-amine,
5-Bromo-2-cyclopentylamino-3-nitropyridine,
ACMC-20986p,
CTK4A1982,
DTXSID60674448,
ANW-14879,
MFCD08692161,
ZINC38537011,
AKOS010476939,
RTR-000789,
AJ-95804,
OR345177,
AX8229099,
BC4271316,
ST2406162,
TR-000789,
Z6645,
A-4271,
I02-3171,
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 | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 286.129g/mol |
| Monoisotopic Mass | 285.011g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 70.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number