| CAS Number | 1203579-13-8 |
| Catalog Number | AG00937G(AGN-PC-0WR1QE) |
| Chemical Name | 3-Chloro-7-bromo-4-hydroxyquinoline |
| IUPAC Name | 7-bromo-3-chloro-1H-quinolin-4-one |
| InChI | InChI=1S/C9H5BrClNO/c10-5-1-2-6-8(3-5)12-4-7(11)9(6)13/h1-4H,(H,12,13) |
| InChI Key | SBLLWZADBFGUOE-UHFFFAOYSA-N |
| MDL Number | MFCD13192873 |
| Molecular Formula | C9H5BrClNO |
| Molecular Weight | 258.4991 |
| SMILES | Brc1ccc2c(c1)ncc(c2O)Cl |
| Synonyms | 3-Chloro-7-bromo-4-hydroxyquinoline,
1203579-13-8,
7-bromo-3-chloroquinolin-4-ol,
SCHEMBL19890447,
DTXSID90671086,
MFCD13192873,
ZINC41702029,
7-Bromo-3-chloroquinolin-4(1H)-one,
FCH1381715,
QC-8079,
OR309324,
T6266,
|
| Complexity | 266 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 256.924g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.499g/mol |
| Monoisotopic Mass | 256.924g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number