| CAS Number | 1369139-60-5 |
| Catalog Number | AG00VUYA(AGN-PC-0WBKST) |
| Chemical Name | 2-Bromo-5-fluoro-4-nitrophenol |
| IUPAC Name | 2-bromo-5-fluoro-4-nitrophenol |
| InChI | InChI=1S/C6H3BrFNO3/c7-3-1-5(9(11)12)4(8)2-6(3)10/h1-2,10H |
| InChI Key | SLYLDENEWMZMFV-UHFFFAOYSA-N |
| MDL Number | MFCD22034975 |
| Molecular Formula | C6H3BrFNO3 |
| Molecular Weight | 235.9953 |
| SMILES | [O-][N+](=O)c1cc(Br)c(cc1F)O |
| Synonyms | 2-bromo-5-fluoro-4-nitrophenol,
1369139-60-5,
SCHEMBL104252,
MFCD22034975,
ZINC82237864,
AKOS016353089,
MCULE-4915020060,
NS-03170,
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| Complexity | 186 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.928g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.996g/mol |
| Monoisotopic Mass | 234.928g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 66A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number