| CAS Number | 1804897-55-9 |
| Catalog Number | AG00I031(AGN-PC-0WNNP5) |
| Chemical Name | 3-Bromo-5-chloro-2-fluorophenol |
| IUPAC Name | 3-bromo-5-chloro-2-fluorophenol |
| InChI | InChI=1S/C6H3BrClFO/c7-4-1-3(8)2-5(10)6(4)9/h1-2,10H |
| InChI Key | NPKWKIGBWZJFJS-UHFFFAOYSA-N |
| MDL Number | MFCD28143932 |
| Molecular Formula | C6H3BrClFO |
| Molecular Weight | 225.4428 |
| SMILES | BrC=1C(=C(C=C(C1)Cl)O)F |
| Synonyms | 3-Bromo-5-chloro-2-fluorophenol,
1804897-55-9,
ZINC216701834,
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| Complexity | 124 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.904g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.441g/mol |
| Monoisotopic Mass | 223.904g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
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Certificate of Analysis
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