| CAS Number | 1065087-83-3 |
| Catalog Number | AG00936Q(AGN-PC-0WR1NQ) |
| Chemical Name | 3-Bromo-8-fluoro-4-hydroxyquinoline |
| IUPAC Name | 3-bromo-8-fluoro-1H-quinolin-4-one |
| InChI | InChI=1S/C9H5BrFNO/c10-6-4-12-8-5(9(6)13)2-1-3-7(8)11/h1-4H,(H,12,13) |
| InChI Key | PXKSZDKDNPVFPM-UHFFFAOYSA-N |
| MDL Number | MFCD13192868 |
| Molecular Formula | C9H5BrFNO |
| Molecular Weight | 242.0445 |
| SMILES | BrC=1C=NC2=C(C=CC=C2C1O)F |
| Synonyms | 3-Bromo-8-fluoro-4-hydroxyquinoline,
1065087-83-3,
3-bromo-8-fluoroquinolin-4-ol,
CTK8E4415,
CTK8F5005,
DTXSID50671082,
MFCD13192868,
ZINC41702009,
3-Bromo-8-fluoroquinolin-4(1H)-one,
AKOS022530694,
QC-7975,
PC404591,
T6129,
3-Bromo-8-fluoro-4-hydroxyquinoline, AldrichCPR,
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| Complexity | 266 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.954g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.047g/mol |
| Monoisotopic Mass | 240.954g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number