| CAS Number | 1804841-26-6 |
| Catalog Number | AG00I02X(AGN-PC-0WQWLQ) |
| Chemical Name | 3-Bromo-2-fluoro-6-nitroaniline |
| IUPAC Name | 3-bromo-2-fluoro-6-nitroaniline |
| InChI | InChI=1S/C6H4BrFN2O2/c7-3-1-2-4(10(11)12)6(9)5(3)8/h1-2H,9H2 |
| InChI Key | SCAQBSHGBYKWET-UHFFFAOYSA-N |
| MDL Number | MFCD26407496 |
| Molecular Formula | C6H4BrFN2O2 |
| Molecular Weight | 235.0106 |
| SMILES | Nc1c([N+](=O)[O-])ccc(Br)c1F |
| Synonyms | 3-BROMO-2-FLUORO-6-NITROANILINE,
1804841-26-6,
ZX-RL006993,
ZINC238562939,
FCH2429559,
PC400010,
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| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.944g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.012g/mol |
| Monoisotopic Mass | 233.944g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 71.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number