| CAS Number | 889939-22-4 |
| Catalog Number | AG00IFJ6(AGN-PC-0WON8Q) |
| Chemical Name | 4-BROMO-3-FLUORO-2-NITROPHENOL |
| IUPAC Name | 4-bromo-3-fluoro-2-nitrophenol |
| InChI | InChI=1S/C6H3BrFNO3/c7-3-1-2-4(10)6(5(3)8)9(11)12/h1-2,10H |
| InChI Key | VQSACDGRYKNYRN-UHFFFAOYSA-N |
| MDL Number | MFCD18803968 |
| Molecular Formula | C6H3BrFNO3 |
| Molecular Weight | 235.9953 |
| SMILES | c1cc(c(c(c1O)N(=O)=O)F)Br |
| Synonyms | 4-BROMO-3-FLUORO-2-NITROPHENOL,
889939-22-4,
4-bromo-2-nitro-fluorphenol,
4-bromo-2-nitro-fluorophenol,
SCHEMBL1670128,
VQSACDGRYKNYRN-UHFFFAOYSA-N,
ZINC71654836,
SY100550,
MFCD18803968 (95%),
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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 | 234.92803g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.99g/mol |
| Monoisotopic Mass | 234.92803g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 66Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number