| CAS Number | 1280786-69-7 |
| Catalog Number | AG000XRT(AGN-PC-0WA68O) |
| Chemical Name | 2-Bromo-4-Nitro-5-(Propylamino)Anisole |
| IUPAC Name | 4-bromo-5-methoxy-2-nitro-N-propylaniline |
| InChI | InChI=1S/C10H13BrN2O3/c1-3-4-12-8-6-10(16-2)7(11)5-9(8)13(14)15/h5-6,12H,3-4H2,1-2H3 |
| InChI Key | YQYSDNLJABVUOY-UHFFFAOYSA-N |
| MDL Number | MFCD18783106 |
| Molecular Formula | C10H13BrN2O3 |
| Molecular Weight | 289.1258 |
| SMILES | CCCNc1cc(OC)c(cc1[N+](=O)[O-])Br |
| Synonyms | 1280786-69-7,
4-BROMO-5-METHOXY-2-NITRO-N-PROPYLANILINE,
2-Bromo-4-nitro-5-(propylamino)anisole,
ACMC-209bdt,
CTK8A9966,
DTXSID50681505,
ANW-19023,
MFCD18783106,
ZINC65336890,
AKOS015894987,
AJ-114924,
AX8229530,
TC-107768,
ST24023382,
Z9396,
A-3273,
Benzenamine, 4-bromo-5-methoxy-2-nitro-N-propyl-,
I05-646,
C10H13BrN2O3,
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| Complexity | 235 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 288.011g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 289.129g/mol |
| Monoisotopic Mass | 288.011g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 67.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number